Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:25 UTC
Update Date2025-03-25 00:54:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209118
Frequency0.5
Structure
Chemical FormulaC10H14N2O
Molecular Mass178.1106
SMILESCC1(O)CCNC1c1cccnc1
InChI KeyIHWKFEMSCSTNJW-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
  • hydroxypyridines
  • methylpyridines
  • organopnictogen compounds
  • pyrrolidines
  • tertiary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • pyrrolidinylpyridine
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • secondary amine
  • tertiary alcohol
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine