ChemSpider 2D Image | N-benzyl-6-(5-fluoro-3-pyridyl)pyrimidin-4-amine | C16H13FN4

N-benzyl-6-(5-fluoro-3-pyridyl)pyrimidin-4-amine

  • Molecular FormulaC16H13FN4
  • Average mass280.300 Da
  • Monoisotopic mass280.112427 Da
  • ChemSpider ID26528819

More details:

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

1823316-78-4 [RN]
4-Pyrimidinamine, 6-(5-fluoro-3-pyridinyl)-N-(phenylmethyl)- [ACD/Index Name]
MFCD22576404
N-Benzyl-6-(5-fluor-3-pyridinyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
N-Benzyl-6-(5-fluoro-3-pyridinyl)-4-pyrimidinamine [ACD/IUPAC Name]
N-Benzyl-6-(5-fluoro-3-pyridinyl)-4-pyrimidinamine [French] [ACD/IUPAC Name]
N-benzyl-6-(5-fluoropyridin-3-yl)pyrimidin-4-amine

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

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

Density: 1.3±0.1 g/cm3
Boiling Point: 478.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 243.1±28.7 °C
Index of Refraction: 1.644
Molar Refractivity: 79.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.03
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 73.17
ACD/KOC (pH 5.5): 750.23
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.71
ACD/KOC (pH 7.4): 755.73
Polar Surface Area: 51 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 218.8±3.0 cm3

Click to predict properties on the Chemicalize site


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