ChemSpider 2D Image | 1-(2-Fluorobenzyl)-N-{[1-(2-pyridinyl)-1H-pyrrol-2-yl]methyl}-3-piperidinamine | C22H25FN4

1-(2-Fluorobenzyl)-N-{[1-(2-pyridinyl)-1H-pyrrol-2-yl]methyl}-3-piperidinamine

  • Molecular FormulaC22H25FN4
  • Average mass364.459 Da
  • Monoisotopic mass364.206329 Da
  • ChemSpider ID22220638

More details:

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

1-(2-Fluorbenzyl)-N-{[1-(2-pyridinyl)-1H-pyrrol-2-yl]methyl}-3-piperidinamin [German] [ACD/IUPAC Name]
1-(2-Fluorobenzyl)-N-{[1-(2-pyridinyl)-1H-pyrrol-2-yl]methyl}-3-piperidinamine [ACD/IUPAC Name]
1-(2-Fluorobenzyl)-N-{[1-(2-pyridinyl)-1H-pyrrol-2-yl]méthyl}-3-pipéridinamine [French] [ACD/IUPAC Name]
3-Piperidinamine, 1-[(2-fluorophenyl)methyl]-N-[[1-(2-pyridinyl)-1H-pyrrol-2-yl]methyl]- [ACD/Index Name]
1-[(2-FLUOROPHENYL)METHYL]-N-{[1-(PYRIDIN-2-YL)-1H-PYRROL-2-YL]METHYL}PIPERIDIN-3-AMINE
1-[(2-FLUOROPHENYL)METHYL]-N-{[1-(PYRIDIN-2-YL)PYRROL-2-YL]METHYL}PIPERIDIN-3-AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 508.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 261.2±30.1 °C
Index of Refraction: 1.620
Molar Refractivity: 107.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 1.61
ACD/KOC (pH 7.4): 14.72
Polar Surface Area: 33 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 44.7±7.0 dyne/cm
Molar Volume: 306.5±7.0 cm3

Click to predict properties on the Chemicalize site


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