ChemSpider 2D Image | [3-(Hydroxymethyl)-1-piperidinyl][4-(4-{[(1-phenylcyclopentyl)methyl]amino}-1-piperidinyl)phenyl]methanone | C30H41N3O2

[3-(Hydroxymethyl)-1-piperidinyl][4-(4-{[(1-phenylcyclopentyl)methyl]amino}-1-piperidinyl)phenyl]methanone

  • Molecular FormulaC30H41N3O2
  • Average mass475.665 Da
  • Monoisotopic mass475.319885 Da
  • ChemSpider ID22210273

More details:

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

[3-(Hydroxymethyl)-1-piperidinyl][4-(4-{[(1-phenylcyclopentyl)methyl]amino}-1-piperidinyl)phenyl]methanon [German] [ACD/IUPAC Name]
[3-(Hydroxymethyl)-1-piperidinyl][4-(4-{[(1-phenylcyclopentyl)methyl]amino}-1-piperidinyl)phenyl]methanone [ACD/IUPAC Name]
[3-(Hydroxyméthyl)-1-pipéridinyl][4-(4-{[(1-phénylcyclopentyl)méthyl]amino}-1-pipéridinyl)phényl]méthanone [French] [ACD/IUPAC Name]
Methanone, [3-(hydroxymethyl)-1-piperidinyl][4-[4-[[(1-phenylcyclopentyl)methyl]amino]-1-piperidinyl]phenyl]- [ACD/Index Name]
{1-[4-(4-{[(1-phenylcyclopentyl)methyl]amino}-1-piperidinyl)benzoyl]-3-piperidinyl}methanol
{1-[4-(4-{[(1-PHENYLCYCLOPENTYL)METHYL]AMINO}PIPERIDIN-1-YL)BENZOYL]PIPERIDIN-3-YL}METHANOL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 675.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 362.3±30.1 °C
Index of Refraction: 1.623
Molar Refractivity: 141.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.13
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 1.53
ACD/KOC (pH 7.4): 9.66
Polar Surface Area: 56 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 402.0±5.0 cm3

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