U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C15H21NO.ClH
Molecular Weight 267.794
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4'-METHYL-.ALPHA.-PYRROLIDINOBUTIOPHENONE HYDROCHLORIDE

SMILES

Cl.CCC(N1CCCC1)C(=O)C2=CC=C(C)C=C2

InChI

InChIKey=KGZQAHAZFKZPTL-UHFFFAOYSA-N
InChI=1S/C15H21NO.ClH/c1-3-14(16-10-4-5-11-16)15(17)13-8-6-12(2)7-9-13;/h6-9,14H,3-5,10-11H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C15H21NO
Molecular Weight 231.3333
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula ClH
Molecular Weight 36.461
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 Sat Dec 16 11:31:51 UTC 2023
Edited
by admin
on Sat Dec 16 11:31:51 UTC 2023
Record UNII
SV19U4TEY0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4'-METHYL-.ALPHA.-PYRROLIDINOBUTIOPHENONE HYDROCHLORIDE
Common Name English
F 1938
Code English
BUTYROPHENONE, 4'-METHYL-2-(1-PYRROLIDINYL)-, HYDROCHLORIDE
Systematic Name English
1-BUTANONE, 1-(4-METHYLPHENYL)-2-(1-PYRROLIDINYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
4-ME-.ALPHA.-PBP HCL
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID60858089
Created by admin on Sat Dec 16 11:31:52 UTC 2023 , Edited by admin on Sat Dec 16 11:31:52 UTC 2023
PRIMARY
MANUFACTURER PRODUCT INFORMATION
4-ME-.ALPHA.-PBP HCL
Created by admin on Sat Dec 16 11:31:52 UTC 2023 , Edited by admin on Sat Dec 16 11:31:52 UTC 2023
PRIMARY Pyrrolidinophenones and butyrophenones are chemical compounds that feature ketone functional groups affixed to the narcotic cathinone. They bear a strong structural relationship with the stimulant .ALPHA.-pyrrolidinopentiophenone (.ALPHA.-PVP Item No. 9001083) and many have been identified as components of designer drugs.1,2,3 4-methoxy-.ALPHA.-Pyrrolidinobutiophenone(4-MeOPBP) (hydrochloride) is a pyrovalerone analog that shares structural features with 4-methoxy PVP (Item No. 14097) and 4-methyl-.ALPHA.-pyrrolidinobutiophenone (Item No. 9001190). The biological and toxicological properties of this compound have not been evaluated. This product is intended only for forensic and research applications.
FDA UNII
SV19U4TEY0
Created by admin on Sat Dec 16 11:31:52 UTC 2023 , Edited by admin on Sat Dec 16 11:31:52 UTC 2023
PRIMARY
PUBCHEM
71750579
Created by admin on Sat Dec 16 11:31:52 UTC 2023 , Edited by admin on Sat Dec 16 11:31:52 UTC 2023
PRIMARY
CAS
1214-15-9
Created by admin on Sat Dec 16 11:31:52 UTC 2023 , Edited by admin on Sat Dec 16 11:31:52 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY