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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:51 UTC
Update Date2025-03-25 01:01:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251381
Frequency0.5
Structure
Chemical FormulaC14H15N3
Molecular Mass225.1266
SMILESc1ccc(N2CCCC2c2cccnc2)nc1
InChI KeyFBOMVROUMMXESO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyrrolidinylpyridines
Direct Parent pyrrolidinylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkaloids and derivatives
  • aminopyridines and derivatives
  • azacyclic compounds
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • pyrrolidinylpyridine
  • heteroaromatic compound
  • alkaloid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • dialkylarylamine
  • pyrrolidine
  • imidolactam
  • aminopyridine