Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:07 UTC
Update Date2025-03-21 18:07:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00069626
Frequency43.3
Structure
Chemical FormulaC10H14N2O
Molecular Mass178.1106
SMILESCn1cc(C2CCCN2)ccc1=O
InChI KeyLBDISVILVFXFMK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyrrolidinylpyridines
Direct Parent pyrrolidinylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • pyridinones
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • pyrrolidinylpyridine
  • heteroaromatic compound
  • secondary amine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyridinone
  • organooxygen compound
  • amine