ChemSpider 2D Image | 4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-N,N-dimethyl-1-piperidinecarboxamide | C21H30N4O4

4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-N,N-dimethyl-1-piperidinecarboxamide

  • Molecular FormulaC21H30N4O4
  • Average mass402.487 Da
  • Monoisotopic mass402.226715 Da
  • ChemSpider ID28470284

More details:

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

1-Piperidinecarboxamide, 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl]-N,N-dimethyl- [ACD/Index Name]
4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-N,N-dimethyl-1-piperidincarboxamid [German] [ACD/IUPAC Name]
4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}-N,N-dimethyl-1-piperidinecarboxamide [ACD/IUPAC Name]
4-{[4-(1,3-Benzodioxol-5-ylméthyl)-1-pipérazinyl]carbonyl}-N,N-diméthyl-1-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1158422-26-4 [RN]
4-(4-Benzo[1,3]dioxol-5-ylmethyl-piperazine-1-carbonyl)-piperidine-1-carboxylic acid dimethylamide
4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide
4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-N,N-dimethylpiperidine-1-carboxamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 585.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 87.4±3.0 kJ/mol
    Flash Point: 307.8±30.1 °C
    Index of Refraction: 1.593
    Molar Refractivity: 107.7±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.48
    ACD/LogD (pH 5.5): 1.06
    ACD/BCF (pH 5.5): 2.96
    ACD/KOC (pH 5.5): 57.34
    ACD/LogD (pH 7.4): 1.47
    ACD/BCF (pH 7.4): 7.71
    ACD/KOC (pH 7.4): 149.33
    Polar Surface Area: 66 Å2
    Polarizability: 42.7±0.5 10-24cm3
    Surface Tension: 55.3±3.0 dyne/cm
    Molar Volume: 317.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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