ChemSpider 2D Image | 2-Methyl-2-propanyl [(3S)-1-(6-ethoxy-4-pyrimidinyl)-3-piperidinyl]carbamate | C16H26N4O3

2-Methyl-2-propanyl [(3S)-1-(6-ethoxy-4-pyrimidinyl)-3-piperidinyl]carbamate

  • Molecular FormulaC16H26N4O3
  • Average mass322.403 Da
  • Monoisotopic mass322.200500 Da
  • ChemSpider ID32793591

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(3S)-1-(6-Éthoxy-4-pyrimidinyl)-3-pipéridinyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(3S)-1-(6-ethoxy-4-pyrimidinyl)-3-piperidinyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(3S)-1-(6-ethoxy-4-pyrimidinyl)-3-piperidinyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(3S)-1-(6-ethoxy-4-pyrimidinyl)-3-piperidinyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 494.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.6±28.7 °C
Index of Refraction: 1.539
Molar Refractivity: 87.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 5.13
ACD/KOC (pH 5.5): 54.87
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 55.36
ACD/KOC (pH 7.4): 591.92
Polar Surface Area: 77 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 50.2±5.0 dyne/cm
Molar Volume: 277.6±5.0 cm3

Click to predict properties on the Chemicalize site


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