Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:09 UTC
Update Date2025-03-25 00:55:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213316
Frequency0.5
Structure
Chemical FormulaC14H16N2
Molecular Mass212.1313
SMILESCN1CCCC1c1ccc2cccnc2c1
InChI KeyKGYGEGRVXHYTEK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass phenylpyrrolidines
Direct Parent phenylpyrrolidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aralkylamines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • polyhalopyridines
  • pyrroles
  • quinolines and derivatives
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • 2-phenylpyrrolidine
  • polyhalopyridine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • aralkylamine
  • pyridine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • quinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound
  • amine
  • tertiary amine