ChemSpider 2D Image | 3-[(1R)-1-(5-Fluoro-2-methoxyphenyl)ethoxy]-5-(1-methyl-1H-1,2,3-triazol-5-yl)-2-pyridinamine | C17H18FN5O2

3-[(1R)-1-(5-Fluoro-2-methoxyphenyl)ethoxy]-5-(1-methyl-1H-1,2,3-triazol-5-yl)-2-pyridinamine

  • Molecular FormulaC17H18FN5O2
  • Average mass343.355 Da
  • Monoisotopic mass343.144440 Da
  • ChemSpider ID34219714
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

2-Pyridinamine, 3-[(1R)-1-(5-fluoro-2-methoxyphenyl)ethoxy]-5-(1-methyl-1H-1,2,3-triazol-5-yl)- [ACD/Index Name]
3-[(1R)-1-(5-Fluor-2-methoxyphenyl)ethoxy]-5-(1-methyl-1H-1,2,3-triazol-5-yl)-2-pyridinamin [German] [ACD/IUPAC Name]
3-[(1R)-1-(5-Fluoro-2-methoxyphenyl)ethoxy]-5-(1-methyl-1H-1,2,3-triazol-5-yl)-2-pyridinamine [ACD/IUPAC Name]
3-[(1R)-1-(5-Fluoro-2-méthoxyphényl)éthoxy]-5-(1-méthyl-1H-1,2,3-triazol-5-yl)-2-pyridinamine [French] [ACD/IUPAC Name]
3-[(1r)-1-(5-Fluoro-2-Methoxyphenyl)ethoxy]-5-(1-Methyl-1h-1,2,3-Triazol-5-Yl)pyridin-2-Amine
3U9

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 537.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 278.8±32.9 °C
Index of Refraction: 1.625
Molar Refractivity: 90.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.53
ACD/KOC (pH 5.5): 20.97
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 21.84
ACD/KOC (pH 7.4): 299.20
Polar Surface Area: 88 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 255.7±7.0 cm3

Click to predict properties on the Chemicalize site






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