Cas no 617714-65-5 (4-Piperidinone, 1-[(3,4-dimethylphenyl)methyl]-)

4-Piperidinone, 1-[(3,4-dimethylphenyl)methyl]- structure
617714-65-5 structure
Product Name:4-Piperidinone, 1-[(3,4-dimethylphenyl)methyl]-
CAS No:617714-65-5
MF:C14H19NO
MW:217.306763887405
CID:1629299
PubChem ID:11959625
Update Time:2025-04-21

4-Piperidinone, 1-[(3,4-dimethylphenyl)methyl]- Chemical and Physical Properties

Names and Identifiers

    • 4-Piperidinone, 1-[(3,4-dimethylphenyl)methyl]-
    • 617714-65-5
    • SCHEMBL12855256
    • 1-[(3,4-dimethylphenyl)methyl]piperidin-4-one
    • AKOS010813737
    • 1-(3,4-Dimethylbenzyl)piperidin-4-one
    • Inchi: 1S/C14H19NO/c1-11-3-4-13(9-12(11)2)10-15-7-5-14(16)6-8-15/h3-4,9H,5-8,10H2,1-2H3
    • InChI Key: KXPWUAPXRYLINQ-UHFFFAOYSA-N
    • SMILES: O=C1CCN(CC2C=CC(C)=C(C)C=2)CC1

Computed Properties

  • Exact Mass: 217.14677
  • Monoisotopic Mass: 217.146664230g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 241
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.9
  • Topological Polar Surface Area: 20.3?2

Experimental Properties

  • PSA: 20.31

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