Cas no 86408-07-3 ((1R,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate)

(1R,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate structure
86408-07-3 structure
Product Name:(1R,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate
CAS No:86408-07-3
MF:C17H34N2O
MW:282.464664936066
CID:1850235
PubChem ID:158943
Update Time:2025-04-21

(1R,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate Chemical and Physical Properties

Names and Identifiers

    • (1R,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate
    • 86408-07-3
    • Carbamimidic acid, N,N'-bis(1-methylethyl)-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1R-(1alpha,2beta,5alpha))-
    • 5-Methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate
    • DTXSID101006810
    • O-((-)-Menthyl)-N,N'-diisopropylisourea
    • Inchi: 1S/C17H34N2O/c1-11(2)15-9-8-14(7)10-16(15)20-17(18-12(3)4)19-13(5)6/h11-16H,8-10H2,1-7H3,(H,18,19)/t14-,15+,16+/m0/s1
    • InChI Key: HNCLVVWSFFKGLX-ARFHVFGLSA-N
    • SMILES: O(/C(=N/C(C)C)/NC(C)C)[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C

Computed Properties

  • Exact Mass: 282.267113712g/mol
  • Monoisotopic Mass: 282.267113712g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 6
  • Complexity: 310
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.1
  • Topological Polar Surface Area: 33.6?2

(1R,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N,N'-dipropan-2-ylcarbamimidate Related Literature

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