Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:38 UTC
Update Date2025-03-21 17:58:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00012323
Frequency369.5
Structure
Chemical FormulaC9H12N2
Molecular Mass148.1
SMILESCC1(c2cccnc2)CNC1
InChI KeyGIBNZRUFALXXHR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • secondary amine
  • azetidine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine