ChemSpider 2D Image | N-[1-(1-Methyl-1H-pyrazol-4-yl)ethyl]-1-[3-(2-methyl-4-pyrimidinyl)phenyl]-4-piperidinamine | C22H28N6

N-[1-(1-Methyl-1H-pyrazol-4-yl)ethyl]-1-[3-(2-methyl-4-pyrimidinyl)phenyl]-4-piperidinamine

  • Molecular FormulaC22H28N6
  • Average mass376.498 Da
  • Monoisotopic mass376.237549 Da
  • ChemSpider ID22523670

More details:

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

4-Piperidinamine, N-[1-(1-methyl-1H-pyrazol-4-yl)ethyl]-1-[3-(2-methyl-4-pyrimidinyl)phenyl]- [ACD/Index Name]
N-[1-(1-Methyl-1H-pyrazol-4-yl)ethyl]-1-[3-(2-methyl-4-pyrimidinyl)phenyl]-4-piperidinamin [German] [ACD/IUPAC Name]
N-[1-(1-Methyl-1H-pyrazol-4-yl)ethyl]-1-[3-(2-methyl-4-pyrimidinyl)phenyl]-4-piperidinamine [ACD/IUPAC Name]
N-[1-(1-Méthyl-1H-pyrazol-4-yl)éthyl]-1-[3-(2-méthyl-4-pyrimidinyl)phényl]-4-pipéridinamine [French] [ACD/IUPAC Name]
N-[1-(1-METHYL-1H-PYRAZOL-4-YL)ETHYL]-1-[3-(2-METHYLPYRIMIDIN-4-YL)PHENYL]PIPERIDIN-4-AMINE
N-[1-(1-METHYLPYRAZOL-4-YL)ETHYL]-1-[3-(2-METHYLPYRIMIDIN-4-YL)PHENYL]PIPERIDIN-4-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: 576.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 302.7±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 113.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): -0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 3.29
ACD/KOC (pH 7.4): 36.21
Polar Surface Area: 59 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 310.3±7.0 cm3

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