Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:10 UTC
Update Date2025-03-25 00:52:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194716
Frequency0.5
Structure
Chemical FormulaC10H18N2
Molecular Mass166.147
SMILESCCN(CC)Cc1cccn1C
InChI KeyTWXIGHIVYYXTJA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-methylpyrroles
  • organopnictogen compounds
  • substituted pyrroles
  • trialkylamines
  • Substituents
  • n-methylpyrrole
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • substituted pyrrole
  • aralkylamine
  • pyrrole
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound