ChemSpider 2D Image | 2'-Cyclohexyl-1'-oxo-N-(2-pyridinylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide | C27H33N3O2

2'-Cyclohexyl-1'-oxo-N-(2-pyridinylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide

  • Molecular FormulaC27H33N3O2
  • Average mass431.570 Da
  • Monoisotopic mass431.257263 Da
  • ChemSpider ID29348921

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2'-Cyclohexyl-1'-oxo-N-(2-pyridinylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamid [German] [ACD/IUPAC Name]
2'-Cyclohexyl-1'-oxo-N-(2-pyridinylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide [ACD/IUPAC Name]
2'-Cyclohexyl-1'-oxo-N-(2-pyridinylméthyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide [French] [ACD/IUPAC Name]
Spiro[cyclohexane-1,3'(2'H)-isoquinoline]-4'-carboxamide, 2'-cyclohexyl-1',4'-dihydro-1'-oxo-N-(2-pyridinylmethyl)- [ACD/Index Name]
1401529-27-8 [RN]
2'-cyclohexyl-1'-oxo-N-(pyridin-2-ylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
2-cyclohexyl-1-oxo-N-(pyridin-2-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 672.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 98.8±3.0 kJ/mol
    Flash Point: 360.5±31.5 °C
    Index of Refraction: 1.620
    Molar Refractivity: 125.0±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.45
    ACD/LogD (pH 5.5): 4.10
    ACD/BCF (pH 5.5): 759.17
    ACD/KOC (pH 5.5): 3957.26
    ACD/LogD (pH 7.4): 4.12
    ACD/BCF (pH 7.4): 796.19
    ACD/KOC (pH 7.4): 4150.22
    Polar Surface Area: 62 Å2
    Polarizability: 49.5±0.5 10-24cm3
    Surface Tension: 57.7±5.0 dyne/cm
    Molar Volume: 355.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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