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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H27FN2O
Molecular Weight 366.4717
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-FLUORO-CUMYL-PICA

SMILES

CC(C)(NC(=O)C1=CN(CCCCCF)C2=C1C=CC=C2)C3=CC=CC=C3

InChI

InChIKey=ZJCYQNSYQBCKOD-UHFFFAOYSA-N
InChI=1S/C23H27FN2O/c1-23(2,18-11-5-3-6-12-18)25-22(27)20-17-26(16-10-4-9-15-24)21-14-8-7-13-19(20)21/h3,5-8,11-14,17H,4,9-10,15-16H2,1-2H3,(H,25,27)

HIDE SMILES / InChI

Molecular Formula C23H27FN2O
Molecular Weight 366.4717
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 18:23:28 GMT 2023
Edited
by admin
on Sat Dec 16 18:23:28 GMT 2023
Record UNII
7BN4RS63UV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-FLUORO-CUMYL-PICA
Common Name English
1-(5-FLUOROPENTYL)-N-(1-METHYL-1-PHENYLETHYL)-1H-INDOLE-3-CARBOXAMIDE
Systematic Name English
5F-CUMYL-PICA
Common Name English
5-FLUOROCUMYL-PICA
Common Name English
1H-INDOLE-3-CARBOXAMIDE, 1-(5-FLUOROPENTYL)-N-(1-METHYL-1-PHENYLETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
7BN4RS63UV
Created by admin on Sat Dec 16 18:23:28 GMT 2023 , Edited by admin on Sat Dec 16 18:23:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID401155696
Created by admin on Sat Dec 16 18:23:28 GMT 2023 , Edited by admin on Sat Dec 16 18:23:28 GMT 2023
PRIMARY
PUBCHEM
117650397
Created by admin on Sat Dec 16 18:23:28 GMT 2023 , Edited by admin on Sat Dec 16 18:23:28 GMT 2023
PRIMARY
CAS
1400742-18-8
Created by admin on Sat Dec 16 18:23:28 GMT 2023 , Edited by admin on Sat Dec 16 18:23:28 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Ki
TARGET -> AGONIST
Ki
Related Record Type Details
ACTIVE MOIETY