ChemSpider 2D Image | 3-[1-(1-Piperidinylmethyl)-1H-indol-3-yl]-1-(1-pyrrolidinyl)-1-propanone | C21H29N3O

3-[1-(1-Piperidinylmethyl)-1H-indol-3-yl]-1-(1-pyrrolidinyl)-1-propanone

  • Molecular FormulaC21H29N3O
  • Average mass339.474 Da
  • Monoisotopic mass339.231049 Da
  • ChemSpider ID21533191

More details:

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

1-Propanone, 3-[1-(1-piperidinylmethyl)-1H-indol-3-yl]-1-(1-pyrrolidinyl)- [ACD/Index Name]
3-[1-(1-Piperidinylmethyl)-1H-indol-3-yl]-1-(1-pyrrolidinyl)-1-propanon [German] [ACD/IUPAC Name]
3-[1-(1-Piperidinylmethyl)-1H-indol-3-yl]-1-(1-pyrrolidinyl)-1-propanone [ACD/IUPAC Name]
3-[1-(1-Pipéridinylméthyl)-1H-indol-3-yl]-1-(1-pyrrolidinyl)-1-propanone [French] [ACD/IUPAC Name]
3-[1-(piperidin-1-ylmethyl)-1H-indol-3-yl]-1-(pyrrolidin-1-yl)propan-1-one
3-[1-(piperidin-1-ylmethyl)indol-3-yl]-1-pyrrolidin-1-ylpropan-1-one
919746-86-4 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 544.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 82.3±3.0 kJ/mol
    Flash Point: 283.0±27.3 °C
    Index of Refraction: 1.630
    Molar Refractivity: 101.9±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.74
    ACD/LogD (pH 5.5): 0.89
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.25
    ACD/LogD (pH 7.4): 2.23
    ACD/BCF (pH 7.4): 11.94
    ACD/KOC (pH 7.4): 71.08
    Polar Surface Area: 28 Å2
    Polarizability: 40.4±0.5 10-24cm3
    Surface Tension: 48.2±7.0 dyne/cm
    Molar Volume: 286.2±7.0 cm3

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