ChemSpider 2D Image | tert-Butyl 3-(((4-methylpyridin-2-yl)amino)methyl)piperidine-1-carboxylate | C17H27N3O2

tert-Butyl 3-(((4-methylpyridin-2-yl)amino)methyl)piperidine-1-carboxylate

  • Molecular FormulaC17H27N3O2
  • Average mass305.415 Da
  • Monoisotopic mass305.210327 Da
  • ChemSpider ID27457308

More details:

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

1,1-Dimethylethyl 3-[[(4-methyl-2-pyridinyl)amino]methyl]-1-piperidinecarboxylate
1-Piperidinecarboxylic acid, 3-[[(4-methyl-2-pyridinyl)amino]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-{[(4-methyl-2-pyridinyl)amino]methyl}-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-{[(4-methyl-2-pyridinyl)amino]methyl}-1-piperidincarboxylat [German] [ACD/IUPAC Name]
3-{[(4-Méthyl-2-pyridinyl)amino]méthyl}-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
939986-31-9 [RN]
tert-Butyl 3-(((4-methylpyridin-2-yl)amino)methyl)piperidine-1-carboxylate
3-[(4-Methyl-pyridin-2-ylamino)-met; hyl]-piperidine-1-carboxylic acid tert-butyl ester
3-[(4-methyl-pyridin-2-ylamino)-methyl ]-piperidine-1-carboxylic acid tert-butyl ester
3-[(4-methylpyridin-2-ylamino)methyl]piperidine-1-carboxylic acid tert-butyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 443.4±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 221.9±23.2 °C
    Index of Refraction: 1.545
    Molar Refractivity: 88.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.98
    ACD/LogD (pH 5.5): 1.89
    ACD/BCF (pH 5.5): 6.69
    ACD/KOC (pH 5.5): 48.33
    ACD/LogD (pH 7.4): 3.28
    ACD/BCF (pH 7.4): 165.95
    ACD/KOC (pH 7.4): 1198.71
    Polar Surface Area: 54 Å2
    Polarizability: 35.0±0.5 10-24cm3
    Surface Tension: 45.0±3.0 dyne/cm
    Molar Volume: 279.1±3.0 cm3

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