Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:01 UTC
Update Date2025-03-21 18:39:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00127081
Frequency20.1
Structure
Chemical FormulaC10H14N2O
Molecular Mass178.1106
SMILESCN1C(=O)CCC1c1ccn(C)c1
InChI KeyIWZLQJSUQDDVMU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • n-methylpyrroles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • n-methylpyrrole
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • heteroaromatic compound
  • substituted pyrrole
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • organooxygen compound