ChemSpider 2D Image | N-(1-Cyclopentyl-3-methyl-1H-pyrazol-5-yl)-2-[4-(1H-purin-6-yl)-1H-pyrazol-1-yl]acetamide | C19H21N9O

N-(1-Cyclopentyl-3-methyl-1H-pyrazol-5-yl)-2-[4-(1H-purin-6-yl)-1H-pyrazol-1-yl]acetamide

  • Molecular FormulaC19H21N9O
  • Average mass391.430 Da
  • Monoisotopic mass391.186920 Da
  • ChemSpider ID24841211

More details:

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

1H-Pyrazole-1-acetamide, N-(1-cyclopentyl-3-methyl-1H-pyrazol-5-yl)-4-(9H-purin-6-yl)- [ACD/Index Name]
N-(1-Cyclopentyl-3-methyl-1H-pyrazol-5-yl)-2-[4-(1H-purin-6-yl)-1H-pyrazol-1-yl]acetamid [German] [ACD/IUPAC Name]
N-(1-Cyclopentyl-3-methyl-1H-pyrazol-5-yl)-2-[4-(1H-purin-6-yl)-1H-pyrazol-1-yl]acetamide [ACD/IUPAC Name]
N-(1-Cyclopentyl-3-méthyl-1H-pyrazol-5-yl)-2-[4-(1H-purin-6-yl)-1H-pyrazol-1-yl]acétamide [French] [ACD/IUPAC Name]
N-(1-cyclopentyl-3-methyl-1H-pyrazol-5-yl)-2-[4-(9H-purin-6-yl)-1H-pyrazol-1-yl]acetamide
N-(2-CYCLOPENTYL-5-METHYLPYRAZOL-3-YL)-2-[4-(9H-PURIN-6-YL)PYRAZOL-1-YL]ACETAMIDE

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

Density: 1.6±0.1 g/cm3
Boiling Point: 799.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.2±3.0 kJ/mol
Flash Point: 437.2±32.9 °C
Index of Refraction: 1.819
Molar Refractivity: 107.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 6.68
ACD/KOC (pH 5.5): 135.25
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 6.07
ACD/KOC (pH 7.4): 122.82
Polar Surface Area: 119 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 72.1±7.0 dyne/cm
Molar Volume: 246.7±7.0 cm3

Click to predict properties on the Chemicalize site


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