Cas no 790667-47-9 ((2s)-2-methyl-4-piperidinone)

(2s)-2-methyl-4-piperidinone structure
(2s)-2-methyl-4-piperidinone structure
Product Name:(2s)-2-methyl-4-piperidinone
CAS No:790667-47-9
MF:C6H11NO
MW:113.157641649246
CID:1794560
PubChem ID:7018623
Update Time:2025-04-21

(2s)-2-methyl-4-piperidinone Chemical and Physical Properties

Names and Identifiers

    • (2s)-2-methyl-4-piperidinone
    • (S)-2-Methylpiperidin-4-one
    • (2S)-2-methylpiperidin-4-one
    • 790667-47-9
    • EN300-6750782
    • SCHEMBL10261945
    • AKOS027469886
    • Inchi: 1S/C6H11NO/c1-5-4-6(8)2-3-7-5/h5,7H,2-4H2,1H3/t5-/m0/s1
    • InChI Key: OFVHMZSKMQPCKB-YFKPBYRVSA-N
    • SMILES: O=C1CCN[C@@H](C)C1

Computed Properties

  • Exact Mass: 113.084063974g/mol
  • Monoisotopic Mass: 113.084063974g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 101
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.3
  • Topological Polar Surface Area: 29.1?2

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