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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:20 UTC
Update Date2025-03-21 18:04:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00051251
Frequency63.8
Structure
Chemical FormulaC11H16N2O
Molecular Mass192.1263
SMILESCN1CCN(c2ccccc2O)CC1
InChI KeyBREKGVCIMLEZSM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent phenylpiperazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aniline and substituted anilines
  • azacyclic compounds
  • dialkylarylamines
  • hydrocarbon derivatives
  • n-arylpiperazines
  • n-methylpiperazines
  • organooxygen compounds
  • organopnictogen compounds
  • trialkylamines
  • o-aminophenols
    • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • tertiary amine
  • azacycle
  • aniline or substituted anilines
  • n-alkylpiperazine
  • aminophenol
  • tertiary aliphatic amine
  • n-methylpiperazine
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpiperazine
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • o-aminophenol
  • amine
  • n-arylpiperazine
  • organooxygen compound