ChemSpider 2D Image | 1-[4-(4-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]carbonyl}phenoxy)-1-piperidinyl]-3-methoxy-1-propanone | C22H32N2O5

1-[4-(4-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]carbonyl}phenoxy)-1-piperidinyl]-3-methoxy-1-propanone

  • Molecular FormulaC22H32N2O5
  • Average mass404.500 Da
  • Monoisotopic mass404.231110 Da
  • ChemSpider ID22867768

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-[4-(4-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]carbonyl}phenoxy)-1-piperidinyl]-3-methoxy-1-propanon [German] [ACD/IUPAC Name]
1-[4-(4-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]carbonyl}phenoxy)-1-piperidinyl]-3-methoxy-1-propanone [ACD/IUPAC Name]
1-[4-(4-{[(2R,6S)-2,6-Diméthyl-4-morpholinyl]carbonyl}phénoxy)-1-pipéridinyl]-3-méthoxy-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[4-[4-[[(2R,6S)-2,6-dimethyl-4-morpholinyl]carbonyl]phenoxy]-1-piperidinyl]-3-methoxy- [ACD/Index Name]
(2R*,6S*)-4-(4-{[1-(3-methoxypropanoyl)-4-piperidinyl]oxy}benzoyl)-2,6-dimethylmorpholine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 594.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 313.5±30.1 °C
Index of Refraction: 1.532
Molar Refractivity: 109.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 8.86
ACD/KOC (pH 5.5): 165.90
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.86
ACD/KOC (pH 7.4): 165.90
Polar Surface Area: 68 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 353.8±3.0 cm3

Click to predict properties on the Chemicalize site


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