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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:06 UTC
Update Date2025-03-25 00:59:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235863
Frequency0.5
Structure
Chemical FormulaC14H18N4O2
Molecular Mass274.143
SMILESCOc1cc2ncnc(N3CCN(C)CC3)c2cc1O
InChI KeyKQCVDPKLKNAZCF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent n-arylpiperazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • aminopyrimidines and derivatives
  • anisoles
  • azacyclic compounds
  • dialkylarylamines
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • n-methylpiperazines
  • organopnictogen compounds
  • quinazolinamines
  • trialkylamines
    • Substituents
  • phenol ether
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • pyrimidine
  • diazanaphthalene
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • imidolactam
  • tertiary amine
  • azacycle
  • n-alkylpiperazine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • n-methylpiperazine
  • aminopyrimidine
  • organic oxygen compound
  • anisole
  • quinazolinamine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • quinazoline
  • amine
  • n-arylpiperazine
  • organooxygen compound