ChemSpider 2D Image | TERT-BUTYL 4-{[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]AMINO}PIPERIDINE-1-CARBOXYLATE | C17H27N5O2

TERT-BUTYL 4-{[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]AMINO}PIPERIDINE-1-CARBOXYLATE

  • Molecular FormulaC17H27N5O2
  • Average mass333.429 Da
  • Monoisotopic mass333.216461 Da
  • ChemSpider ID28303562

More details:

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

1353946-67-4 [RN]
1-Piperidinecarboxylic acid, 4-[[6-(cyclopropylamino)-4-pyrimidinyl]amino]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-{[6-(cyclopropylamino)-4-pyrimidinyl]amino}-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-{[6-(cyclopropylamino)-4-pyrimidinyl]amino}-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-{[6-(Cyclopropylamino)-4-pyrimidinyl]amino}-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
TERT-BUTYL 4-{[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]AMINO}PIPERIDINE-1-CARBOXYLATE
4-(6-Cyclopropylaminopyrimidin-4-ylamino)piperidine-1-carboxylic acid tert-butyl ester
4-(6-Cyclopropylaminopyrimidin-4-ylamino)-piperidine-1-carboxylic acid tert-butyl ester
4-(6-Cyclopropylamino-pyrimidin-4-ylamino)-piperidine-1-carboxylic acid tert-butyl ester
MFCD21098660 [MDL number]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 522.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.6±3.0 kJ/mol
    Flash Point: 269.6±30.1 °C
    Index of Refraction: 1.625
    Molar Refractivity: 93.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.45
    ACD/LogD (pH 5.5): 2.70
    ACD/BCF (pH 5.5): 44.70
    ACD/KOC (pH 5.5): 330.21
    ACD/LogD (pH 7.4): 3.40
    ACD/BCF (pH 7.4): 221.67
    ACD/KOC (pH 7.4): 1637.52
    Polar Surface Area: 79 Å2
    Polarizability: 37.1±0.5 10-24cm3
    Surface Tension: 66.2±3.0 dyne/cm
    Molar Volume: 264.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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