Cas no 383128-39-0 (2-(3,5-Dimethylphenyl)piperidine)

2-(3,5-Dimethylphenyl)piperidine is a substituted piperidine derivative featuring a 3,5-dimethylphenyl group at the 2-position. This compound is of interest in organic synthesis and medicinal chemistry due to its structural framework, which serves as a versatile intermediate for the development of pharmacologically active molecules. The dimethylphenyl moiety enhances steric and electronic properties, potentially influencing binding affinity and selectivity in target interactions. Its piperidine core contributes to conformational rigidity, making it valuable in the design of ligands for receptor studies. The compound is typically handled under controlled conditions due to its reactive functional groups, ensuring stability and purity for research applications.
2-(3,5-Dimethylphenyl)piperidine structure
383128-39-0 structure
Product Name:2-(3,5-Dimethylphenyl)piperidine
CAS No:383128-39-0
MF:C13H19N
MW:189.29666352272
MDL:MFCD02663617
CID:3055982
PubChem ID:5104361
Update Time:2025-11-03

2-(3,5-Dimethylphenyl)piperidine Chemical and Physical Properties

Names and Identifiers

    • 2-(3,5-Dimethyl-phenyl)-piperidine
    • SY278075
    • CS-0153262
    • N12511
    • BBL020709
    • SB42058
    • 383128-39-0
    • 2-(3,5-dimethylphenyl)piperidine
    • BS-50365
    • EN300-1153282
    • MFCD02663617
    • STK893399
    • AKOS001476371
    • 2-(3,5-Dimethylphenyl)piperidine
    • MDL: MFCD02663617
    • Inchi: 1S/C13H19N/c1-10-7-11(2)9-12(8-10)13-5-3-4-6-14-13/h7-9,13-14H,3-6H2,1-2H3
    • InChI Key: ITOUMWCWDRQGPJ-UHFFFAOYSA-N
    • SMILES: N1CCCCC1C1C=C(C)C=C(C)C=1

Computed Properties

  • Exact Mass: 189.151749610g/mol
  • Monoisotopic Mass: 189.151749610g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 168
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.9
  • Topological Polar Surface Area: 12?2

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