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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H26N2O.ClH
Molecular Weight 358.905
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZYLFENTANYL HYDROCHLORIDE

SMILES

Cl.CCC(=O)N(C1CCN(CC2=CC=CC=C2)CC1)C3=CC=CC=C3

InChI

InChIKey=IHEUGHQOXFVWOX-UHFFFAOYSA-N
InChI=1S/C21H26N2O.ClH/c1-2-21(24)23(19-11-7-4-8-12-19)20-13-15-22(16-14-20)17-18-9-5-3-6-10-18;/h3-12,20H,2,13-17H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H26N2O
Molecular Weight 322.4439
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: P35372|||G8XRH8|||Q5TDA1|||Q9UN57
Gene ID: 4988.0
Gene Symbol: OPRM1
Target Organism: Homo sapiens (Human)
213.0 nM [Ki]
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:57:50 UTC 2023
Edited
by admin
on Sat Dec 16 08:57:50 UTC 2023
Record UNII
ECF9JW6J8Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYLFENTANYL HYDROCHLORIDE
Common Name English
N-(1-BENZYL-4-PIPERIDYL)-N-PHENYLPROPANAMIDE HYDROCHLORIDE
Systematic Name English
BENZYL FENTANYL HYDROCHLORIDE
Common Name English
PROPIONANILIDE, N-(1-BENZYL-4-PIPERIDYL)-, HYDROCHLORIDE
Systematic Name English
Classification Tree Code System Code
DEA NO. 8334
Created by admin on Sat Dec 16 08:57:50 UTC 2023 , Edited by admin on Sat Dec 16 08:57:50 UTC 2023
Code System Code Type Description
FDA UNII
ECF9JW6J8Q
Created by admin on Sat Dec 16 08:57:50 UTC 2023 , Edited by admin on Sat Dec 16 08:57:50 UTC 2023
PRIMARY
PUBCHEM
60196318
Created by admin on Sat Dec 16 08:57:50 UTC 2023 , Edited by admin on Sat Dec 16 08:57:50 UTC 2023
PRIMARY
CAS
5156-58-1
Created by admin on Sat Dec 16 08:57:50 UTC 2023 , Edited by admin on Sat Dec 16 08:57:50 UTC 2023
PRIMARY
EPA CompTox
DTXSID4048933
Created by admin on Sat Dec 16 08:57:50 UTC 2023 , Edited by admin on Sat Dec 16 08:57:50 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE