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Predicted properties of the compound entered.

ID QKDDJDBFONZGBW-UHFFFAOYSA-N
Formula C15H24N4S
IUPAC Name N-cyclohexyl-4-(1H-imidazol-4-yl)piperidine-1-carbothioamide
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
Standard InChIKey (User Input) InChIKey=QKDDJDBFONZGBW-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers N-cyclohexyl-4-(3H-imidazol-4-yl)piperidine-1-carbothioamide | N-cyclohexyl-4-(3H-imidazol-4-yl)-1-piperidinecarbothioamide | 106243-16-7 | N-Cyclohexy-4-(imidazol-4-yl)-1-piperidinecarbothioamide | NCGC00024704-03 | NCGC00015988-01 | Lopac0_001214 | NCGC00024704-01 | Tocris-0644 | 1-Piperidinecarbothioamide, N-cyclohexyl-4-(1H-imidazol-4-yl)- | MR 12842 | Lopac-T-123 | Thioperamide
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
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1H NMR prediction -
13C NMR prediction -
COSY -
HSQC/HMBC prediction -
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