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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19NO
Molecular Weight 205.2961
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IBUPROFENAMIDE, (S)-

SMILES

CC(C)CC1=CC=C(C=C1)[C@H](C)C(N)=O

InChI

InChIKey=REUQKCDCQVNKLW-JTQLQIEISA-N
InChI=1S/C13H19NO/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H2,14,15)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H19NO
Molecular Weight 205.2961
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:10:32 GMT 2025
Edited
by admin
on Mon Mar 31 22:10:32 GMT 2025
Record UNII
1XJS2M4809
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IBUPROFENAMIDE, (S)-
Common Name English
(S)-2-(4-(ISOBUTYLPHENYL)PROPANAMIDE
Preferred Name English
BENZENEACETAMIDE, .ALPHA.-METHYL-4-(2-METHYLPROPYL)-, (.ALPHA.S)-
Common Name English
(S)-IBUPROFENAMIDE
Common Name English
BENZENEACETAMIDE, .ALPHA.-METHYL-4-(2-METHYLPROPYL)-, (S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID901238697
Created by admin on Mon Mar 31 22:10:32 GMT 2025 , Edited by admin on Mon Mar 31 22:10:32 GMT 2025
PRIMARY
PUBCHEM
715796
Created by admin on Mon Mar 31 22:10:32 GMT 2025 , Edited by admin on Mon Mar 31 22:10:32 GMT 2025
PRIMARY
CAS
121839-86-9
Created by admin on Mon Mar 31 22:10:32 GMT 2025 , Edited by admin on Mon Mar 31 22:10:32 GMT 2025
PRIMARY
FDA UNII
1XJS2M4809
Created by admin on Mon Mar 31 22:10:32 GMT 2025 , Edited by admin on Mon Mar 31 22:10:32 GMT 2025
PRIMARY