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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:46 UTC
Update Date2025-03-25 00:57:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226096
Frequency0.5
Structure
Chemical FormulaC10H17N3O2
Molecular Mass211.1321
SMILESCC(=O)NCCc1ncc(CN(C)C)o1
InChI KeyKWYINFNSSSISBU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent 2,5-disubstituted oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • amino acids and derivatives
  • aralkylamines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary carboxylic acid amides
  • trialkylamines
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • 2,5-disubstituted 1,3-oxazole
  • carboxylic acid derivative
  • aralkylamine
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • tertiary amine
  • acetamide
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound