Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:07 UTC
Update Date2025-03-21 17:57:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00008751
Frequency557.4
Structure
Chemical FormulaC9H12N2
Molecular Mass148.1
SMILESc1ccc(C2CCCN2)nc1
InChI KeyNDCZQFDBSPOUDF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent 2-halopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyridines and derivatives
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • pyrrolidine
  • amine