ChemSpider 2D Image | (2S)-2-(Dimethylamino)-N-{(2S,3S,4R)-3-hydroxy-5-[(5S)-5-isopropyl-3,3-dimethyl-2,4-dioxo-1-pyrrolidinyl]-4-methyl-5-oxo-2-pentanyl}propanamide (non-preferred name) | C20H35N3O5

(2S)-2-(Dimethylamino)-N-{(2S,3S,4R)-3-hydroxy-5-[(5S)-5-isopropyl-3,3-dimethyl-2,4-dioxo-1-pyrrolidinyl]-4-methyl-5-oxo-2-pentanyl}propanamide (non-preferred name)

  • Molecular FormulaC20H35N3O5
  • Average mass397.509 Da
  • Monoisotopic mass397.257660 Da
  • ChemSpider ID35516842

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(2S)-2-(Dimethylamino)-N-{(2S,3S,4R)-3-hydroxy-5-[(5S)-5-isopropyl-3,3-dimethyl-2,4-dioxo-1-pyrrolidinyl]-4-methyl-5-oxo-2-pentanyl}propanamid (non-preferred name) [German] [ACD/IUPAC Name]
(2S)-2-(Dimethylamino)-N-{(2S,3S,4R)-3-hydroxy-5-[(5S)-5-isopropyl-3,3-dimethyl-2,4-dioxo-1-pyrrolidinyl]-4-methyl-5-oxo-2-pentanyl}propanamide (non-preferred name) [ACD/IUPAC Name]
(2S)-2-(Diméthylamino)-N-{(2S,3S,4R)-3-hydroxy-5-[(5S)-5-isopropyl-3,3-diméthyl-2,4-dioxo-1-pyrrolidinyl]-4-méthyl-5-oxo-2-pentanyl}propanamide (non-preferred name) [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 589.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.0±6.0 kJ/mol
Flash Point: 310.3±30.1 °C
Index of Refraction: 1.503
Molar Refractivity: 105.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.17
ACD/LogD (pH 5.5): -0.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.18
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.51
ACD/KOC (pH 7.4): 39.77
Polar Surface Area: 107 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 355.3±3.0 cm3

Click to predict properties on the Chemicalize site


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