Cas no 1187930-87-5 ((S)-1-Cyclohexyl-3-methylpiperazine)

(S)-1-Cyclohexyl-3-methylpiperazine is a chiral piperazine derivative featuring a cyclohexyl substituent at the 1-position and a methyl group at the 3-position. This compound is of interest in pharmaceutical and agrochemical research due to its stereospecificity, which can influence biological activity and receptor binding. The cyclohexyl group enhances lipophilicity, potentially improving membrane permeability, while the methyl substitution offers steric control for selective interactions. Its rigid structure and defined stereochemistry make it a valuable intermediate in asymmetric synthesis and drug development, particularly for targeting central nervous system (CNS) disorders. High-purity grades ensure reproducibility in research applications.
(S)-1-Cyclohexyl-3-methylpiperazine structure
1187930-87-5 structure
Product Name:(S)-1-Cyclohexyl-3-methylpiperazine
CAS No:1187930-87-5
MF:C11H22N2
MW:182.305782794952
MDL:MFCD04115053
CID:1038060
PubChem ID:70700404
Update Time:2025-06-09

(S)-1-Cyclohexyl-3-methylpiperazine Chemical and Physical Properties

Names and Identifiers

    • (S)-1-Cyclohexyl-3-methylpiperazine
    • (3S)-1-cyclohexyl-3-methylpiperazine
    • (S)-1-Cyclohexyl-3-methyl-piperazine
    • DTXSID70743250
    • 1187930-87-5
    • A892853
    • AKOS016843088
    • DB-258142
    • CS-0005355
    • Piperazine, 1-cyclohexyl-3-Methyl-, (3S)-
    • MDL： MFCD04115053
    • Inchi： 1S/C11H22N2/c1-10-9-13(8-7-12-10)11-5-3-2-4-6-11/h10-12H,2-9H2,1H3/t10-/m0/s1
    • InChI Key： NZVWAQIJRNKNOB-JTQLQIEISA-N
    • SMILES： N1(CCN[C@@H](C)C1)C1CCCCC1

Computed Properties

  • Exact Mass: 182.17800
  • Monoisotopic Mass: 182.178298710g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 152
  • 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: 1.9
  • Topological Polar Surface Area: 15.3?2

Experimental Properties

  • PSA: 15.27000
  • LogP: 1.87950

(S)-1-Cyclohexyl-3-methylpiperazine Pricemore >>

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