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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H25FN2O
Molecular Weight 352.4451
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ORTHO-FLUORO ACRYLFENTANYL

SMILES

FC1=C(C=CC=C1)N(C2CCN(CCC3=CC=CC=C3)CC2)C(=O)C=C

InChI

InChIKey=ROBNYLIAYXEIFM-UHFFFAOYSA-N
InChI=1S/C22H25FN2O/c1-2-22(26)25(21-11-7-6-10-20(21)23)19-13-16-24(17-14-19)15-12-18-8-4-3-5-9-18/h2-11,19H,1,12-17H2

HIDE SMILES / InChI

Molecular Formula C22H25FN2O
Molecular Weight 352.4451
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 Thu Jul 06 20:59:25 UTC 2023
Edited
by admin
on Thu Jul 06 20:59:25 UTC 2023
Record UNII
1RWM4U7RIO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ORTHO-FLUORO ACRYLFENTANYL
Common Name English
N-(2-FLUOROPHENYL)-N-(1-(2-PHENYLETHYL)PIPERIDIN-4-YL)PROP-2-ENAMIDE
Systematic Name English
ORTHO-FLUOROACRYL FENTANYL
Common Name English
2-PROPENAMIDE, N-(2-FLUOROPHENYL)-N-(1-(2-PHENYLETHYL)-4-PIPERIDINYL)-
Systematic Name English
N-(2-FLUOROPHENYL)-N-(1-PHENETHYLPIPERIDIN-4-YL)ACRYLAMIDE
Common Name English
ORTHO-FLUORO ACRYLFENTANYL [NFLIS-DRUG]
Common Name English
2-FLUORO ACRYLFENTANYL
Common Name English
O-FLUORO ACRYL FENTANY
Common Name English
Classification Tree Code System Code
DEA NO. 9852
Created by admin on Thu Jul 06 20:59:25 UTC 2023 , Edited by admin on Thu Jul 06 20:59:25 UTC 2023
Code System Code Type Description
PUBCHEM
137699952
Created by admin on Thu Jul 06 20:59:25 UTC 2023 , Edited by admin on Thu Jul 06 20:59:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID301036807
Created by admin on Thu Jul 06 20:59:25 UTC 2023 , Edited by admin on Thu Jul 06 20:59:25 UTC 2023
PRIMARY
CAS
2309383-09-1
Created by admin on Thu Jul 06 20:59:25 UTC 2023 , Edited by admin on Thu Jul 06 20:59:25 UTC 2023
PRIMARY
FDA UNII
1RWM4U7RIO
Created by admin on Thu Jul 06 20:59:25 UTC 2023 , Edited by admin on Thu Jul 06 20:59:25 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> AGONIST
BINDING
Ki
TARGET -> AGONIST
EC50
Related Record Type Details
ACTIVE MOIETY