Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:38 UTC
Update Date2025-03-25 00:59:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234776
Frequency0.5
Structure
Chemical FormulaC10H13N3O
Molecular Mass191.1059
SMILESCNc1ncccc1C1CCC(=O)N1
InChI KeyCNUYWJVRTHKXSD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyrrolidinylpyridines
Direct Parent pyrrolidinylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • lactams
  • methylpyridines
  • organic oxides
  • organopnictogen compounds
  • polyhalopyridines
  • pyrrolidine-2-ones
  • secondary alkylarylamines
  • secondary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • pyrrolidinylpyridine
  • polyhalopyridine
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • pyrrolidine
  • imidolactam
  • pyrrolidone
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • secondary amine
  • carboxamide group
  • secondary aliphatic/aromatic amine
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine