GABAPENTIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H17NO2
Molecular Weight	171.2368
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of GABAPENTIN

Structure Search

SMILES

NCC1(CC(O)=O)CCCCC1

InChI

InChIKey=UGJMXCAKCUNAIE-UHFFFAOYSA-N

InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C9H17NO2
Molecular Weight	171.2368
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:06:57 UTC 2023` Edited by `admin` on `Fri Dec 15 15:06:57 UTC 2023`
Record UNII	6CW7F3G59X
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

GABAPENTIN

Official Name

English

CYCLOHEXANEACETIC ACID, 1-(AMINOMETHYL)-

Common Name

English

gabapentin [INN]

Common Name

English

GABAPENTIN [ORANGE BOOK]

Common Name

English

GRALISE

Brand Name

English

GABAPENTIN [USP-RS]

Common Name

English

1-(Aminomethyl)cyclohexaneacetic acid

Systematic Name

English

Gabapentin [WHO-DD]

Common Name

English

GABAPENTIN [MART.]

Common Name

English

GABAPENTIN [MI]

Common Name

English

GABAPENTIN [JAN]

Common Name

English

NSC-742194

Code

English

GABAPENTIN [EP IMPURITY]

Common Name

English

NSC-759254

Code

English

GABAPENTIN [USAN]

Common Name

English

GABAPENTIN [HSDB]

Common Name

English

GABAPENTIN [USP MONOGRAPH]

Common Name

English

GABAPENTIN [VANDF]

Common Name

English

GABAPENTIN [EP MONOGRAPH]

Common Name

English

GOE 3450

Code

English

DM-1796

Code

English

CARBATIN

Systematic Name

English

GOE-3450

Code

English

GABAPENTINE

Common Name

English

CI-945

Code

English

Classification Tree Code System Code

WHO-VATC

QN03AX12

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

WHO-ATC

N03AX12

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

FDA ORPHAN DRUG

236506

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

NDF-RT

N0000008486

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

NDF-RT

N0000175753

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

FDA ORPHAN DRUG

88695

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

NCI_THESAURUS

C29756

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

LIVERTOX

NBK548252

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

Code System Code Type Description

USAN

AA-108

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

FDA UNII

6CW7F3G59X

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

MESH

C040029

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

SMS_ID

100000092663

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

MERCK INDEX

m5618

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

Merck Index

IUPHAR

5483

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

NCI_THESAURUS

C1108

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

CAS

60142-96-3

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

HSDB

7364

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

DAILYMED

6CW7F3G59X

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

ECHA (EC/EINECS)

262-076-3

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

DRUG BANK

DB00996

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

INN

5094

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

NSC

742194

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

EVMPD

SUB07857MIG

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

PUBCHEM

3446

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

RXCUI

25480

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

RxNorm

RS_ITEM_NUM

1287303

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

NSC

759254

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

CHEBI

42797

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

ChEMBL

CHEMBL940

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

LACTMED

Gabapentin

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

DRUG CENTRAL

1264

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

EPA CompTox

DTXSID0020074

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

WIKIPEDIA

GABAPENTIN

Created by admin on Fri Dec 15 15:06:57 UTC 2023 , Edited by admin on Fri Dec 15 15:06:57 UTC 2023

PRIMARY

Related Record Type Details


					N0PY5N5AFW

GABAPENTIN HYDROCHLORIDE

SALT/SOLVATE -> PARENT


					6CW7F3G59X

BASIS OF STRENGTH->SUBSTANCE

Interaction Type:

ASSAY (HPLC)

Qualification:

USP

Amount:


					7PXD8ZD6PL

GABAPENTIN HYDROBROMIDE

SALT/SOLVATE -> PARENT

Amount:


					515ZW3T4Z5

OCTN-1

TRANSPORTER -> SUBSTRATE


					6CW7F3G59X

BASIS OF STRENGTH->SUBSTANCE

Interaction Type:

ASSAY (HPLC)

Qualification:

EP

Amount:


					4KHYO80GXC

CD98

TRANSPORTER -> SUBSTRATE

Qualification:

CLINICALLY SIGNIFICANT


					6D53G0FD0Z

PLASMA PROTEIN FRACTION (HUMAN)

BINDER->LIGAND

Interaction Type:

BINDING

Amount:


					Z2CHJ67SHZ

VOLTAGE-DEPENDENT CALCIUM CHANNEL SUBUNIT ALPHA-2/DELTA-1

TARGET->LIGAND

Related Record Type Details


					75OCL1SPBQ

GABAPENTIN ENACARBIL

PRODRUG -> METABOLITE ACTIVE

Amount:

Related Record Type Details


					BJ25YSI2X8

1-CARBOXYCYCLOHEXANEACETIC ACID

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					0IP6953295

GABAPENTIN LACTAM

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					0IP6953295

GABAPENTIN LACTAM

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount:


					E1393FZ76L

(1-CYANOCYCLOHEXYL)ACETIC ACID

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

Related Record Type Details


					6CW7F3G59X

ACTIVE MOIETY

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
Biological Half-life	PHARMACOKINETIC				RENAL IMPAIRMENT PHARMACOKINETIC

Biological Half-life	PHARMACOKINETIC

Volume of Distribution	PHARMACOKINETIC

Tmax	PHARMACOKINETIC				IMMEDIATE-RELEASE PHARMACOKINETIC

ORAL BIOAVAILABILITY	PHARMACOKINETIC

MAXIMUM TOLERATED DOSE	TOXICITY