Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:42 UTC
Update Date2025-03-25 00:59:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234937
Frequency0.5
Structure
Chemical FormulaC12H17N3
Molecular Mass203.1422
SMILESc1cncc(CN2CC3CNCC3C2)c1
InChI KeyQVYMGYMFILJLRH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • pyridines and derivatives
  • trialkylamines
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • n-alkylpyrrolidine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • secondary amine
  • aralkylamine
  • pyridine
  • aromatic heteropolycyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • pyrrolidine
  • tertiary amine
  • organoheterocyclic compound