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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H17F3N2O
Molecular Weight 286.2928
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Amino-6-methyl-5-phenyl-1-(2,2,2-trifluoroethyl)-2-piperidinone, (3S,5S,6R)-

SMILES

C[C@@H]1[C@@H](C[C@H](N)C(=O)N1CC(F)(F)F)C2=CC=CC=C2

InChI

InChIKey=VKOYIDUVQJQGCB-JLLWLGSASA-N
InChI=1S/C14H17F3N2O/c1-9-11(10-5-3-2-4-6-10)7-12(18)13(20)19(9)8-14(15,16)17/h2-6,9,11-12H,7-8,18H2,1H3/t9-,11-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H17F3N2O
Molecular Weight 286.2928
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:23:11 GMT 2025
Edited
by admin
on Wed Apr 02 18:23:11 GMT 2025
Record UNII
63J4AT94JV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Amino-6-methyl-5-phenyl-1-(2,2,2-trifluoroethyl)-2-piperidinone, (3S,5S,6R)-
Systematic Name English
(3S,5S,6R)-3-Amino-6-methyl-5-phenyl-1-(2,2,2-trifluoroethyl)-2-piperidinone
Preferred Name English
(3S,5S,6R)-3-Amino-6-methyl-5-phenyl-1-(2,2,2-trifluoroethyl)piperidin-2-one
Systematic Name English
2-Piperidinone, 3-amino-6-methyl-5-phenyl-1-(2,2,2-trifluoroethyl)-, (3S,5S,6R)-
Systematic Name English
Code System Code Type Description
FDA UNII
63J4AT94JV
Created by admin on Wed Apr 02 18:23:11 GMT 2025 , Edited by admin on Wed Apr 02 18:23:11 GMT 2025
PRIMARY
CAS
1375794-69-6
Created by admin on Wed Apr 02 18:23:11 GMT 2025 , Edited by admin on Wed Apr 02 18:23:11 GMT 2025
PRIMARY
PUBCHEM
68749752
Created by admin on Wed Apr 02 18:23:11 GMT 2025 , Edited by admin on Wed Apr 02 18:23:11 GMT 2025
PRIMARY