ChemSpider 2D Image | 2-{2-[4-Methyl-6-(2-pyrazinylamino)-2-pyrimidinyl]-1-piperidinyl}-N-(1-methyl-1H-pyrazol-3-yl)acetamide | C20H25N9O

2-{2-[4-Methyl-6-(2-pyrazinylamino)-2-pyrimidinyl]-1-piperidinyl}-N-(1-methyl-1H-pyrazol-3-yl)acetamide

  • Molecular FormulaC20H25N9O
  • Average mass407.472 Da
  • Monoisotopic mass407.218201 Da
  • ChemSpider ID80808182

More details:

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

1-Piperidineacetamide, 2-[4-methyl-6-(2-pyrazinylamino)-2-pyrimidinyl]-N-(1-methyl-1H-pyrazol-3-yl)- [ACD/Index Name]
2-{2-[4-Methyl-6-(2-pyrazinylamino)-2-pyrimidinyl]-1-piperidinyl}-N-(1-methyl-1H-pyrazol-3-yl)acetamid [German] [ACD/IUPAC Name]
2-{2-[4-Methyl-6-(2-pyrazinylamino)-2-pyrimidinyl]-1-piperidinyl}-N-(1-methyl-1H-pyrazol-3-yl)acetamide [ACD/IUPAC Name]
2-{2-[4-Méthyl-6-(2-pyrazinylamino)-2-pyrimidinyl]-1-pipéridinyl}-N-(1-méthyl-1H-pyrazol-3-yl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 670.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 359.5±31.5 °C
Index of Refraction: 1.717
Molar Refractivity: 114.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.47
ACD/LogD (pH 7.4): 1.82
ACD/BCF (pH 7.4): 13.63
ACD/KOC (pH 7.4): 213.09
Polar Surface Area: 114 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 290.4±7.0 cm3

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