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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:43 UTC
Update Date2025-03-25 00:46:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155189
Frequency0.5
Structure
Chemical FormulaC11H14N4O
Molecular Mass218.1168
SMILESCc1cc(C)c2c(=O)nc(N(C)C)[nH]c2n1
InChI KeyVFYRDJCUJARJEZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridopyrimidines
Subclass pyrido[2,3-d]pyrimidines
Direct Parent pyrido[2,3-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aminopyrimidines and derivatives
  • azacyclic compounds
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyrimidones
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • pyrimidone
  • methylpyridine
  • pyrimidine
  • aminopyrimidine
  • organic oxide
  • pyridine
  • organic oxygen compound
  • pyrido[2,3-d]pyrimidine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • dialkylarylamine
  • organooxygen compound