ChemSpider 2D Image | N-({5-[(4,7-Dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-(4-morpholinylmethyl)cyclopentanamine | C24H35N3O6

N-({5-[(4,7-Dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-(4-morpholinylmethyl)cyclopentanamine

  • Molecular FormulaC24H35N3O6
  • Average mass461.551 Da
  • Monoisotopic mass461.252594 Da
  • ChemSpider ID22752136

More details:

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

3-Isoxazolemethanamine, 5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-N-[1-(4-morpholinylmethyl)cyclopentyl]- [ACD/Index Name]
N-({5-[(4,7-Dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-(4-morpholinylmethyl)cyclopentanamin [German] [ACD/IUPAC Name]
N-({5-[(4,7-Dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-(4-morpholinylmethyl)cyclopentanamine [ACD/IUPAC Name]
N-({5-[(4,7-Diméthoxy-1,3-benzodioxol-5-yl)méthyl]-4,5-dihydro-1,2-oxazol-3-yl}méthyl)-1-(4-morpholinylméthyl)cyclopentanamine [French] [ACD/IUPAC Name]
({5-[(4,7-dimethoxy(2H-benzo[d]1,3-dioxolan-5-yl))methyl](4,5-dihydroisoxazol-3-yl)}methyl)[(morpholin-4-ylmethyl)cyclopentyl]amine
[5-(4,7-Dimethoxy-benzo[1,3]dioxol-5-ylmethyl)-4,5-dihydro-isoxazol-3-ylmethyl]-(1-morpholin-4-ylmethyl-cyclopentyl)-amine
N-({5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-(morpholin-4-ylmethyl)cyclopentanamine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 571.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 299.6±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 119.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.69
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 38.41
ACD/KOC (pH 7.4): 319.41
Polar Surface Area: 83 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 48.8±7.0 dyne/cm
Molar Volume: 338.8±7.0 cm3

Click to predict properties on the Chemicalize site


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