ChemSpider 2D Image | N-{3-[Benzyl(methyl)amino]propyl}-1-[(1-ethyl-1H-indol-3-yl)methyl]-4-piperidinecarboxamide | C28H38N4O

N-{3-[Benzyl(methyl)amino]propyl}-1-[(1-ethyl-1H-indol-3-yl)methyl]-4-piperidinecarboxamide

  • Molecular FormulaC28H38N4O
  • Average mass446.628 Da
  • Monoisotopic mass446.304565 Da
  • ChemSpider ID29188831

More details:

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

4-Piperidinecarboxamide, 1-[(1-ethyl-1H-indol-3-yl)methyl]-N-[3-[methyl(phenylmethyl)amino]propyl]- [ACD/Index Name]
N-{3-[Benzyl(methyl)amino]propyl}-1-[(1-ethyl-1H-indol-3-yl)methyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-{3-[Benzyl(methyl)amino]propyl}-1-[(1-ethyl-1H-indol-3-yl)methyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-{3-[Benzyl(méthyl)amino]propyl}-1-[(1-éthyl-1H-indol-3-yl)méthyl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-{3-[BENZYL(METHYL)AMINO]PROPYL}-1-[(1-ETHYL-1H-INDOL-3-YL)METHYL]PIPERIDINE-4-CARBOXAMIDE
N-{3-[BENZYL(METHYL)AMINO]PROPYL}-1-[(1-ETHYLINDOL-3-YL)METHYL]PIPERIDINE-4-CARBOXAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 633.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.1±31.5 °C
Index of Refraction: 1.597
Molar Refractivity: 136.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 9.68
ACD/KOC (pH 7.4): 46.00
Polar Surface Area: 41 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 43.1±7.0 dyne/cm
Molar Volume: 401.5±7.0 cm3

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