Hmdb loader

Showing information for DMID02172202

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:16 UTC
Update Date2025-03-25 00:49:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172202
Frequency0.5
Structure
Chemical FormulaC11H17N3
Molecular Mass191.1422
SMILESCN1CCCC1CNc1ccccn1
InChI KeyXLHYCRFKUSZGHT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • methylpyridines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • secondary aliphatic/aromatic amine
  • pyridine
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • pyrrolidine
  • imidolactam
  • tertiary amine
  • organoheterocyclic compound