[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane

C10H19F3N2O3S — CID 103834038

IUPAC[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane
SMILESCN(C1CCCCC1)S(=O)(=O)NCC(O)C(F)(F)F
InChIInChI=1S/C10H19F3N2O3S/c1-15(8-5-3-2-4-6-8)19(17,18)14-7-9(16)10(11,12)13/h8-9,14,16H,2-7H2,1H3
InChIKeyNPFZEDULJOSYKV-UHFFFAOYSA-N
MW304.33 g/mol
LogP1.01
Rot. Bonds5

About [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane

[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane (PubChem CID 103834038) has the molecular formula C10H19F3N2O3S and a molecular weight of 304.33 g/mol. Its IUPAC name is [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane.

Molecular Properties

Compound Name[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane
PubChem CID103834038
Molecular FormulaC10H19F3N2O3S
Molecular Weight304.33 g/mol
Exact Mass304.11
IUPAC Name[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane
SMILESCN(C1CCCCC1)S(=O)(=O)NCC(O)C(F)(F)F
InChIInChI=1S/C10H19F3N2O3S/c1-15(8-5-3-2-4-6-8)19(17,18)14-7-9(16)10(11,12)13/h8-9,14,16H,2-7H2,1H3
InChIKeyNPFZEDULJOSYKV-UHFFFAOYSA-N
XLogP1.01
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[(2-hydroxy-4,4-dimethylpentyl)sulfamoyl-methylamino]cyclohexane
CID 103835504
[2-hydroxypentylsulfamoyl(methyl)amino]cyclohexane
CID 115754506
N-(3,3,3-trifluoro-2-hydroxypropyl)cyclohexanesulfonamide
CID 113242615
[methyl-[[2-methyl-3-(methylamino)propyl]sulfamoyl]amino]cyclohexane
CID 113282568
[2-(diethylamino)propylsulfamoyl-methylamino]cyclohexane
CID 47034025
[(2-amino-4-methylpentyl)sulfamoyl-methylamino]cyclohexane
CID 43606374
[5-hydroxypentylsulfamoyl(methyl)amino]cyclohexane
CID 107319547
[3-aminobutylsulfamoyl(methyl)amino]cyclohexane
CID 63253809
N-[2-[[cyclohexyl(methyl)sulfamoyl]amino]ethyl]acetamide
CID 47157246
[2-(ethylamino)ethylsulfamoyl-methylamino]cyclohexane
CID 55100441
[[(2S)-3,3-dimethyl-2-(propan-2-ylamino)butyl]sulfamoyl-methylamino]cyclopropane
CID 58826078
4-[methyl(2-methylpropylsulfamoyl)amino]azepane
CID 107172951

Frequently Asked Questions

What is the IUPAC name of [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane?
The IUPAC name of [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane (CID 103834038) is [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane.
What is the SMILES notation for [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane?
The canonical SMILES for [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane is CN(C1CCCCC1)S(=O)(=O)NCC(O)C(F)(F)F.
What is the InChIKey of [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane?
The InChIKey is NPFZEDULJOSYKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O3S/c1-15(8-5-3-2-4-6-8)19(17,18)14-7-9(16)10(11,12)13/h8-9,14,16H,2-7H2,1H3.
What are the key properties of [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane?
[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane has a molecular weight of 304.33 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane is sourced from PubChem (CID 103834038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).