Summary

IMPPAT Phytochemical identifier: IMPHY002691

Phytochemical name: 2-Phenylpyridine

Synonymous chemical names:
2-phenyl-pyridine

External chemical identifiers:
CID:13887, ChEMBL:CHEMBL1193163, ZINC:ZINC000011535683, FDASRS:2Y6S09838Q, SureChEMBL:SCHEMBL35754, MolPort-001-763-924

---

Chemical structure information

SMILES:
c1ccc(cc1)c1ccccn1

InChI:
InChI=1S/C11H9N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-9H

InChIKey:
VQGHOUODWALEFC-UHFFFAOYSA-N

DeepSMILES:
cccccc6))cccccn6

Functional groups:
cnc

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc(-c2ccccn2)cc1

Scaffold Graph/Node level:
C1CCC(C2CCCCN2)CC1

Scaffold Graph level:
C1CCC(C2CCCCC2)CC1

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Pyridines and derivatives

ClassyFire Subclass: Phenylpyridines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Nicotinic acid alkaloids

NP Classifier Class: Pyridine alkaloids

NP-Likeness score: -1.225

---

Chemical structure download