Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:31 UTC
Update Date2025-03-25 01:01:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248283
Frequency0.5
Structure
Chemical FormulaC18H24N2
Molecular Mass268.1939
SMILESCc1ccccc1C(CCCN(C)C)c1ccccn1
InChI KeyGMMLLSRJAOPSSR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylbutylamines
Direct Parent phenylbutylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organopnictogen compounds
  • toluenes
  • trialkylamines
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • phenylbutylamine
  • pyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • toluene
  • amine
  • tertiary amine
  • organoheterocyclic compound