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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:08 UTC
Update Date2025-03-21 17:57:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00011133
Frequency417.8
Structure
Chemical FormulaC10H14N2O
Molecular Mass178.1106
SMILESCN1CC(O)CC1c1cccnc1
InChI KeyQMZDJTKDTYAGGJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyrrolidinylpyridines
Direct Parent pyrrolidinylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • alkaloids and derivatives
  • aralkylamines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • aromatic heteromonocyclic compound
  • pyrrolidinylpyridine
  • aralkylamine
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • tertiary amine
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • heteroaromatic compound
  • tertiary aliphatic amine
  • hydroxypyridine
  • methylpyridine
  • alkaloid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound