N-(4-HYDROXYPENTYL) APINACA

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H31N3O2
Molecular Weight	381.5111
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-(4-HYDROXYPENTYL) APINACA

Structure Search

SMILES

CC(O)CCCN1N=C(C(=O)NC23CC4CC(CC(C4)C2)C3)C5=C1C=CC=C5

InChI

InChIKey=RTBQZNKCFFBCBJ-UHFFFAOYSA-N

InChI=1S/C23H31N3O2/c1-15(27)5-4-8-26-20-7-3-2-6-19(20)21(25-26)22(28)24-23-12-16-9-17(13-23)11-18(10-16)14-23/h2-3,6-7,15-18,27H,4-5,8-14H2,1H3,(H,24,28)

HIDE SMILES / InChI

Molecular Formula	C23H31N3O2
Molecular Weight	381.5111
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 21:21:26 GMT 2025` Edited by `admin` on `Tue Apr 01 21:21:26 GMT 2025`
Record UNII	SK7ZNR9WGH
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

N-(4-HYDROXYPENTYL) APINACA

Common Name

English

AKB48 N-(4-HYDROXYPENTYL) METABOLITE

Preferred Name

English

AKB-48 N-(4-HYDROXYPENTYL)

Common Name

English

1H-INDAZOLE-3-CARBOXAMIDE, 1-(4-HYDROXYPENTYL)-N-TRICYCLO(3.3.1.13,7)DEC-1-YL-

Systematic Name

English

1-(4-HYDROXYPENTYL)-N-TRICYCLO(3.3.1.13,7)DEC-1-YL-1H-INDAZOLE-3-CARBOXAMIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

SK7ZNR9WGH

Created by admin on Tue Apr 01 21:21:27 GMT 2025 , Edited by admin on Tue Apr 01 21:21:27 GMT 2025

PRIMARY

PUBCHEM

132988808

Created by admin on Tue Apr 01 21:21:27 GMT 2025 , Edited by admin on Tue Apr 01 21:21:27 GMT 2025

PRIMARY

CAS

1843184-41-7

Created by admin on Tue Apr 01 21:21:27 GMT 2025 , Edited by admin on Tue Apr 01 21:21:27 GMT 2025

PRIMARY

EPA CompTox

DTXSID001342411

Created by admin on Tue Apr 01 21:21:27 GMT 2025 , Edited by admin on Tue Apr 01 21:21:27 GMT 2025

PRIMARY