ChemSpider 2D Image | 2-Iodo-N-{[4-(1-pyrrolidinyl)-2-pyrimidinyl]methyl}benzamide | C16H17IN4O

2-Iodo-N-{[4-(1-pyrrolidinyl)-2-pyrimidinyl]methyl}benzamide

  • Molecular FormulaC16H17IN4O
  • Average mass408.237 Da
  • Monoisotopic mass408.044708 Da
  • ChemSpider ID58469346

More details:

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

2-Iod-N-{[4-(1-pyrrolidinyl)-2-pyrimidinyl]methyl}benzamid [German] [ACD/IUPAC Name]
2-Iodo-N-{[4-(1-pyrrolidinyl)-2-pyrimidinyl]methyl}benzamide [ACD/IUPAC Name]
2-Iodo-N-{[4-(1-pyrrolidinyl)-2-pyrimidinyl]méthyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-iodo-N-[[4-(1-pyrrolidinyl)-2-pyrimidinyl]methyl]- [ACD/Index Name]
2-iodo-N-((4-(pyrrolidin-1-yl)pyrimidin-2-yl)methyl)benzamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 546.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.6±3.0 kJ/mol
Flash Point: 284.5±27.3 °C
Index of Refraction: 1.661
Molar Refractivity: 93.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 24.16
ACD/KOC (pH 5.5): 277.83
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.59
ACD/KOC (pH 7.4): 558.79
Polar Surface Area: 58 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 253.5±3.0 cm3

Click to predict properties on the Chemicalize site


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