fentanyl

Ligand id: 1626

Name: fentanyl

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 23.55
Molecular weight 336.22
XLogP 6.73
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1968))
IUPAC Name
N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
International Nonproprietary Names
INN number INN
1608 fentanyl
Synonyms
Abstral® | Actiq® | Durogesic® | MCN-JR-4263-49 | R-4263 | Sublimaze®
Database Links
BindingDB Ligand 50008984
CAS Registry No. 437-38-7 (source: DrugBank)
ChEBI CHEBI:119915
ChEMBL Ligand CHEMBL596
DrugBank Ligand DB00813
PubChem CID 3345
Search Google for chemical match using the InChIKey PJMPHNIQZUBGLI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PJMPHNIQZUBGLI
Search PubMed clinical trials fentanyl
Search PubMed titles fentanyl
Search PubMed titles/abstracts fentanyl
Search UniChem for chemical match using the InChIKey PJMPHNIQZUBGLI-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PJMPHNIQZUBGLI
Wikipedia Fentanyl
Comments
Fentanyl is a potent, addiction-forming narcotic analgesic. Marketed formulations contain the citrate salt (PubChem CID 13810).