ChemSpider 2D Image | N-[2-(Dimethylamino)ethyl]-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide | C14H18N4O5

N-[2-(Dimethylamino)ethyl]-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide

  • Molecular FormulaC14H18N4O5
  • Average mass322.316 Da
  • Monoisotopic mass322.127716 Da
  • ChemSpider ID23492738

More details:

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

1,2,4-Oxadiazole-5-carboxamide, N-[2-(dimethylamino)ethyl]-3-[[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl]- [ACD/Index Name]
N-[2-(Dimethylamino)ethyl]-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazol-5-carboxamid [German] [ACD/IUPAC Name]
N-[2-(Dimethylamino)ethyl]-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide [ACD/IUPAC Name]
N-[2-(Diméthylamino)éthyl]-3-{[(2-méthyl-4-oxo-4H-pyran-3-yl)oxy]méthyl}-1,2,4-oxadiazole-5-carboxamide [French] [ACD/IUPAC Name]
1144466-13-6 [RN]
3-(2-Methyl-4-oxo-4H-pyran-3-yloxymethyl)-[1,2,4]oxadiazole-5-carboxylic acid (2-dimethylamino-ethyl)-amide
N-[2-(dimethylamino)ethyl]-3-[(2-methyl-4-oxopyran-3-yl)oxymethyl]-1,2,4-oxadiazole-5-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:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.565
    Molar Refractivity: 79.0±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: -0.21
    ACD/LogD (pH 5.5): -2.46
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.78
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 5.01
    Polar Surface Area: 107 Å2
    Polarizability: 31.3±0.5 10-24cm3
    Surface Tension: 59.5±5.0 dyne/cm
    Molar Volume: 242.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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