ChemSpider 2D Image | (2S)-N-{[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}-2-(1H-tetrazol-1-yl)propanamide | C12H22N6O2

(2S)-N-{[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}-2-(1H-tetrazol-1-yl)propanamide

  • Molecular FormulaC12H22N6O2
  • Average mass282.342 Da
  • Monoisotopic mass282.180420 Da
  • ChemSpider ID52614483
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2S)-N-{[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}-2-(1H-tetrazol-1-yl)propanamid [German] [ACD/IUPAC Name]
(2S)-N-{[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}-2-(1H-tetrazol-1-yl)propanamide [ACD/IUPAC Name]
(2S)-N-{[4-(Diméthylamino)tétrahydro-2H-pyran-4-yl]méthyl}-2-(1H-tétrazol-1-yl)propanamide [French] [ACD/IUPAC Name]
1H-Tetrazole-1-acetamide, N-[[4-(dimethylamino)tetrahydro-2H-pyran-4-yl]methyl]-α-methyl-, (αS)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.613
Molar Refractivity: 75.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -2.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.68
Polar Surface Area: 85 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 49.6±7.0 dyne/cm
Molar Volume: 215.8±7.0 cm3

Click to predict properties on the Chemicalize site






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