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Search term: CZBLKBKVAIKTJH-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-{3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-fluorophenyl}-N-cyclopropyl-N'-methyl-1,2-ethanediamine | C20H27FN4

N-{3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-fluorophenyl}-N-cyclopropyl-N'-methyl-1,2-ethanediamine

  • Molecular FormulaC20H27FN4
  • Average mass342.454 Da
  • Monoisotopic mass342.221985 Da
  • ChemSpider ID35034356

More details:

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

1,2-Ethanediamine, N1-[3-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-5-fluorophenyl]-N1-cyclopropyl-N2-methyl- [ACD/Index Name]
N-{3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-fluorophenyl}-N-cyclopropyl-N'-methyl-1,2-ethanediamine [ACD/IUPAC Name]
N-{3-[2-(6-Amino-4-méthyl-2-pyridinyl)éthyl]-5-fluorophényl}-N-cyclopropyl-N'-méthyl-1,2-éthanediamine [French] [ACD/IUPAC Name]
N-{3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-fluorphenyl}-N-cyclopropyl-N'-methyl-1,2-ethandiamin [German] [ACD/IUPAC Name]
N1-(3-(2-(6-Amino-4-Methylpyridin-2-Yl)ethyl)-5-Fluorophenyl)-N1-Cyclopropyl-N2-Methylethane-1,2-Diamine
S90

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

Density: 1.2±0.1 g/cm3
Boiling Point: 506.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 259.8±30.1 °C
Index of Refraction: 1.625
Molar Refractivity: 101.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 2.41
ACD/KOC (pH 7.4): 15.26
Polar Surface Area: 54 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 288.1±3.0 cm3

Click to predict properties on the Chemicalize site


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