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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:58 UTC
Update Date2025-03-25 00:52:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194277
Frequency0.5
Structure
Chemical FormulaC10H11N3O2
Molecular Mass205.0851
SMILESCN1CC(=O)NC(=O)C1c1ccccn1
InChI KeyRWKQRAZTUHXGOJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent pyridinylpiperazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • alpha amino acids
  • aralkylamines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • dioxopiperazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • n-methylpiperazines
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • aralkylamine
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • dioxopiperazine
  • pyridinylpiperazine
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • dicarboximide
  • 2-halopyridine
  • tertiary amine
  • azacycle
  • n-alkylpiperazine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • n-methylpiperazine
  • methylpyridine
  • carboxylic acid imide
  • pyridine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound