ChemSpider 2D Image | N-(2,6-Difluorobenzyl)-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide | C18H20F2N2O2

N-(2,6-Difluorobenzyl)-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide

  • Molecular FormulaC18H20F2N2O2
  • Average mass334.360 Da
  • Monoisotopic mass334.149292 Da
  • ChemSpider ID32513557

More details:

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

2H-Pyran-4-acetamide, N-[(2,6-difluorophenyl)methyl]tetrahydro-4-(1H-pyrrol-1-yl)- [ACD/Index Name]
N-(2,6-Difluorbenzyl)-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamid [German] [ACD/IUPAC Name]
N-(2,6-Difluorobenzyl)-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide [ACD/IUPAC Name]
N-(2,6-Difluorobenzyl)-2-[4-(1H-pyrrol-1-yl)tétrahydro-2H-pyran-4-yl]acétamide [French] [ACD/IUPAC Name]
1630832-43-7 [RN]
Benzoic acid, 4-(aminomethyl)- (9CI) [ACD/Index Name]
N-[(2,6-difluorophenyl)methyl]-2-(4-pyrrol-1-yloxan-4-yl)acetamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 525.4±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.9±3.0 kJ/mol
    Flash Point: 271.5±30.1 °C
    Index of Refraction: 1.568
    Molar Refractivity: 87.4±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.94
    ACD/LogD (pH 5.5): 2.36
    ACD/BCF (pH 5.5): 36.42
    ACD/KOC (pH 5.5): 456.27
    ACD/LogD (pH 7.4): 2.36
    ACD/BCF (pH 7.4): 36.42
    ACD/KOC (pH 7.4): 456.27
    Polar Surface Area: 43 Å2
    Polarizability: 34.6±0.5 10-24cm3
    Surface Tension: 41.6±7.0 dyne/cm
    Molar Volume: 267.2±7.0 cm3

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