Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:22 UTC
Update Date2025-03-21 17:59:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00020610
Frequency196.1
Structure
Chemical FormulaC11H14N2
Molecular Mass174.1157
SMILESCn1cc(CCN)c2ccccc21
InChI KeyCAAGZPJPCKMFBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass n-alkylindoles
Direct Parent n-alkylindoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • monoalkylamines
  • n-methylpyrroles
  • organonitrogen compounds
  • organopnictogen compounds
  • substituted pyrroles
  • Substituents
  • n-methylpyrrole
  • n-alkylindole
  • azacycle
  • indole
  • heteroaromatic compound
  • substituted pyrrole
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound