Cas no 13290-48-7 ((3-methylphenyl)(piperidin-1-yl)methanone)

(3-methylphenyl)(piperidin-1-yl)methanone structure
13290-48-7 structure
Product Name:(3-methylphenyl)(piperidin-1-yl)methanone
CAS No:13290-48-7
MF:C13H17NO
MW:203.280183553696
CID:1231824
PubChem ID:83314
Update Time:2025-04-20

(3-methylphenyl)(piperidin-1-yl)methanone Chemical and Physical Properties

Names and Identifiers

    • (3-methylphenyl)(piperidin-1-yl)methanone
    • 1-(3-Methylbenzoyl)piperidine
    • methanone, (3-methylphenyl)-1-piperidinyl-
    • Piperidine, 1-(3-methylbenzoyl)-
    • (3-methylphenyl)-piperidin-1-ylmethanone
    • 3-Methylphenyl(piperidino) ketone
    • AA-504/07992063
    • R 228
    • DTXSID80157844
    • R-228
    • AKOS003869238
    • 13290-48-7
    • m-toluic acid piperidide
    • SCHEMBL12969
    • AI3-31642
    • Inchi: 1S/C13H17NO/c1-11-6-5-7-12(10-11)13(15)14-8-3-2-4-9-14/h5-7,10H,2-4,8-9H2,1H3
    • InChI Key: RZQSYVFYSMVASQ-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=C(C)C=1)N1CCCCC1

Computed Properties

  • Exact Mass: 203.13111
  • Monoisotopic Mass: 203.131014166g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 221
  • 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: 3.1
  • Topological Polar Surface Area: 20.3?2

Experimental Properties

  • PSA: 20.31
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