ChemSpider 2D Image | 2-[(1H-Imidazol-4-ylmethyl)amino]-N-propylbenzamide | C14H18N4O

2-[(1H-Imidazol-4-ylmethyl)amino]-N-propylbenzamide

  • Molecular FormulaC14H18N4O
  • Average mass258.319 Da
  • Monoisotopic mass258.148071 Da
  • ChemSpider ID23199518

More details:

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

2-[(1H-Imidazol-4-ylmethyl)amino]-N-propylbenzamid [German] [ACD/IUPAC Name]
2-[(1H-Imidazol-4-ylmethyl)amino]-N-propylbenzamide [ACD/IUPAC Name]
2-[(1H-Imidazol-4-ylméthyl)amino]-N-propylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 2-[(1H-imidazol-4-ylmethyl)amino]-N-propyl- [ACD/Index Name]
2-[(3H-Imidazol-4-ylmethyl)-amino]-N-propyl-benzamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL325745/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 546.6±35.0 °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: 284.4±25.9 °C
Index of Refraction: 1.624
Molar Refractivity: 75.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.53
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 9.71
ACD/KOC (pH 7.4): 164.86
Polar Surface Area: 70 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 214.5±3.0 cm3

Click to predict properties on the Chemicalize site


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