Summary

IMPPAT Phytochemical identifier: IMPHY017165

Phytochemical name: 4-Aminopyridine

Synonymous chemical names:
4-pyridinamine

External chemical identifiers:
CID:1727, ChEMBL:CHEMBL284348, ChEBI:34385, ZINC:ZINC000000599985, FDASRS:BH3B64OKL9, SureChEMBL:SCHEMBL53483, MolPort-000-146-022

---

Chemical structure information

SMILES:
Nc1ccncc1

InChI:
InChI=1S/C5H6N2/c6-5-1-3-7-4-2-5/h1-4H,(H2,6,7)

InChIKey:
NUKYPUAOHBNCPY-UHFFFAOYSA-N

DeepSMILES:
Ncccncc6

Functional groups:
cN, cnc

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccncc1

Scaffold Graph/Node level:
C1CCNCC1

Scaffold Graph level:
C1CCCCC1

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Pyridines and derivatives

ClassyFire Subclass: Aminopyridines and derivatives

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Nicotinic acid alkaloids

NP-Likeness score: -0.659

---

Chemical structure download