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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H23NO
Molecular Weight 221.3385
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TAPENTADOL

SMILES

CC[C@H]([C@@H](C)CN(C)C)C1=CC=CC(O)=C1

InChI

InChIKey=KWTWDQCKEHXFFR-SMDDNHRTSA-N
InChI=1S/C14H23NO/c1-5-14(11(2)10-15(3)4)12-7-6-8-13(16)9-12/h6-9,11,14,16H,5,10H2,1-4H3/t11-,14+/m0/s1

HIDE SMILES / InChI
Molecular Formula C14H23NO
Molecular Weight 221.3385
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
123738
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:27:08 UTC 2023
Edited
by admin
on Fri Dec 15 16:27:08 UTC 2023
Record UNII
H8A007M585
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAPENTADOL
DASH   INN   MART.   MI   USAN   VANDF   WHO-DD  
INN   USAN  
Official Name English
TAPENTADOL [USAN]
Common Name English
3-[(1R,2R)-3-(Dimethylamino)-1-ethyl-2-methylpropyl]phenol
Systematic Name English
tapentadol [INN]
Common Name English
TAPENTADOL [VANDF]
Common Name English
NSC-759619
Code English
PHENOL, 3-((1R,2R)-3-(DIMETHYLAMINO)-1-ETHYL-2-METHYLPROPYL)-
Systematic Name English
CG-5503
Code English
CG5503 IR
Code English
BN-200
Code English
TAPENTADOL [MI]
Common Name English
TAPENTADOL [MART.]
Common Name English
Tapentadol [WHO-DD]
Common Name English
CG5503
Code English
Classification Tree Code System Code
NDF-RT N0000175690
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
NCI_THESAURUS C241
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
WHO-VATC QN02AX06
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
WHO-ATC N02AX06
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
LIVERTOX 923
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
DEA NO. 9780
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
NDF-RT N0000000174
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
Code System Code Type Description
IUPHAR
7477
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
HSDB
8309
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
NCI_THESAURUS
C72139
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID30170003
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
NSC
759619
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
DRUG BANK
DB06204
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
MERCK INDEX
m10459
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY Merck Index
PUBCHEM
9838022
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
DRUG CENTRAL
4283
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
CAS
175591-23-8
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
LACTMED
Tapentadol
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
DAILYMED
H8A007M585
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
WIKIPEDIA
TAPENTADOL
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
FDA UNII
H8A007M585
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
USAN
QQ-108
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
EVMPD
SUB31821
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
MESH
C523979
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
INN
8216
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
SMS_ID
100000124502
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
ChEMBL
CHEMBL1201776
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY
RXCUI
787390
Created by admin on Fri Dec 15 16:27:08 UTC 2023 , Edited by admin on Fri Dec 15 16:27:08 UTC 2023
PRIMARY RxNorm
Related Record Type Details
PLASMA PROTEIN FRACTION (HUMAN)
BINDER->LIGAND
MU-TYPE OPIOID RECEPTOR
TARGET -> AGONIST
Structure of TAPENTADOL MALEATE HEMIHYDRATE
SALT/SOLVATE -> PARENT
Structure of TAPENTADOL MALEATE
SALT/SOLVATE -> PARENT
SODIUM-DEPENDENT NORADRENALINE TRANSPORTER
TARGET -> INHIBITOR
Structure of TAPENTADOL PHOSPHATE
SALT/SOLVATE -> PARENT
Structure of TAPENTADOL HYDROCHLORIDE
SALT/SOLVATE -> PARENT
PLASMA PROTEIN FRACTION (HUMAN)
BINDER->LIGAND
BINDING
SODIUM-DEPENDENT NORADRENALINE TRANSPORTER
TARGET -> INHIBITOR
Structure of TAPENTADOL HYDROBROMIDE
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of N,N-DIDEMETHYLTAPENTADOL
METABOLITE -> PARENT
In vitro and in vivo
Structure of N-ACETYL-9-AMINOMINOCYCLINE, (4R)-
METABOLITE INACTIVE -> PARENT
MAJOR
PLASMA
Structure of TAPENTADOL O-SULFATE
METABOLITE INACTIVE -> PARENT
no clinically relevant active metabolites
MINOR
URINE
Structure of N-ACETYL-9-AMINOMINOCYCLINE, (4R)-
METABOLITE INACTIVE -> PARENT
MAJOR
PLASMA
Structure of N-DEMETHYLTAPENTADOL
METABOLITE INACTIVE -> PARENT
Structure of N-DEMETHYLTAPENTADOL-O-GLUCURONIDE
METABOLITE INACTIVE -> PARENT
URINE
Structure of N-DEMETHYLTAPENTADOL
METABOLITE INACTIVE -> PARENT
No active metabolites of Tapentadol
URINE
Related Record Type Details
Structure of TAPENTADOL
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Volume of Distribution PHARMACOKINETIC
Biological Half-life PHARMACOKINETIC
NIH
NCATS
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