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Details

Stereochemistry RACEMIC
Molecular Formula C22H25FN4O2
Molecular Weight 396.4579
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5F-APP-PINACA, (±)-

SMILES

NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NN(CCCCCF)C3=CC=CC=C23

InChI

InChIKey=OJTAHWMZBJRSIR-UHFFFAOYSA-N
InChI=1S/C22H25FN4O2/c23-13-7-2-8-14-27-19-12-6-5-11-17(19)20(26-27)22(29)25-18(21(24)28)15-16-9-3-1-4-10-16/h1,3-6,9-12,18H,2,7-8,13-15H2,(H2,24,28)(H,25,29)

HIDE SMILES / InChI

Molecular Formula C22H25FN4O2
Molecular Weight 396.4579
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 Sat Dec 16 19:11:30 GMT 2023
Edited
by admin
on Sat Dec 16 19:11:30 GMT 2023
Record UNII
A6YX9823A7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5F-APP-PINACA, (±)-
Common Name English
1H-INDAZOLE-3-CARBOXAMIDE, N-(2-AMINO-2-OXO-1-(PHENYLMETHYL)ETHYL)-1-(5-FLUOROPENTYL)-
Systematic Name English
N-(1-CARBAMOYL-2-PHENYLETHYL)-1-(5-FLUOROPENTYL)-1H-INDAZOLE-3-CARBOXAMIDE
Systematic Name English
PPA(N)-2201
Code English
Code System Code Type Description
FDA UNII
A6YX9823A7
Created by admin on Sat Dec 16 19:11:30 GMT 2023 , Edited by admin on Sat Dec 16 19:11:30 GMT 2023
PRIMARY
CAS
2205029-76-9
Created by admin on Sat Dec 16 19:11:30 GMT 2023 , Edited by admin on Sat Dec 16 19:11:30 GMT 2023
PRIMARY
PUBCHEM
139596415
Created by admin on Sat Dec 16 19:11:30 GMT 2023 , Edited by admin on Sat Dec 16 19:11:30 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE