ChemSpider 2D Image | PF 429242 | C25H35N3O2

PF 429242

  • Molecular FormulaC25H35N3O2
  • Average mass409.564 Da
  • Monoisotopic mass409.272919 Da
  • ChemSpider ID23295379

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-4-((Diethylamino)methyl)-N-(2-methoxyphenethyl)-N-(pyrrolidin-3-yl)benzamide
4-[(Diethylamino)methyl]-N-[2-(2-methoxyphenyl)ethyl]-N-[(3R)-3-pyrrolidinyl]benzamid [German] [ACD/IUPAC Name]
4-[(Diethylamino)methyl]-N-[2-(2-methoxyphenyl)ethyl]-N-[(3R)-3-pyrrolidinyl]benzamide [ACD/IUPAC Name]
4-[(Diéthylamino)méthyl]-N-[2-(2-méthoxyphényl)éthyl]-N-[(3R)-3-pyrrolidinyl]benzamide [French] [ACD/IUPAC Name]
4-[(diethylamino)methyl]-N-[2-(2-methoxyphenyl)ethyl]-N-[(3R)-pyrrolidin-3-yl]benzamide
947303-87-9 [RN]
Benzamide, 4-[(diethylamino)methyl]-N-[2-(2-methoxyphenyl)ethyl]-N-[(3R)-3-pyrrolidinyl]- [ACD/Index Name]
PF 429242
PF-429242
(R)-4-((Diethylamino)methyl)-N-(2-methoxyphenethyl)-N-(pyrrolidin-3-yl)benz amide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

49WB3OA7VN [DBID]
UNII:49WB3OA7VN [DBID]
UNII-49WB3OA7VN [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 562.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.5±3.0 kJ/mol
    Flash Point: 293.8±30.1 °C
    Index of Refraction: 1.586
    Molar Refractivity: 122.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 2.88
    ACD/LogD (pH 5.5): -0.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 45 Å2
    Polarizability: 48.7±0.5 10-24cm3
    Surface Tension: 49.1±5.0 dyne/cm
    Molar Volume: 366.3±5.0 cm3

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