Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:44 UTC
Update Date2025-03-25 00:52:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193767
Frequency0.5
Structure
Chemical FormulaC17H19FN2
Molecular Mass270.1532
SMILESCN(C)CCC=C(c1ccc(F)cc1)c1ccccn1
InChI KeyVKRPMCHQPPEXLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • aryl fluorides
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organofluorides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aryl fluoride
  • aromatic heteromonocyclic compound
  • azacycle
  • organofluoride
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • organohalogen compound
  • aryl halide
  • fluorobenzene
  • pyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organoheterocyclic compound