[1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane

C10H22N2O3S — CID 43502138

IUPAC[1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane
SMILESCC(CO)NS(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C10H22N2O3S/c1-9(8-13)11-16(14,15)12(2)10-6-4-3-5-7-10/h9-11,13H,3-8H2,1-2H3
InChIKeyFMQMLOQRCCCCRJ-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.47
Rot. Bonds5

About [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane

[1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane (PubChem CID 43502138) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane.

Molecular Properties

Compound Name[1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane
PubChem CID43502138
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name[1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane
SMILESCC(CO)NS(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C10H22N2O3S/c1-9(8-13)11-16(14,15)12(2)10-6-4-3-5-7-10/h9-11,13H,3-8H2,1-2H3
InChIKeyFMQMLOQRCCCCRJ-UHFFFAOYSA-N
XLogP0.47
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane?
The IUPAC name of [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane (CID 43502138) is [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane.
What is the SMILES notation for [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane?
The canonical SMILES for [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane is CC(CO)NS(=O)(=O)N(C)C1CCCCC1.
What is the InChIKey of [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane?
The InChIKey is FMQMLOQRCCCCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-9(8-13)11-16(14,15)12(2)10-6-4-3-5-7-10/h9-11,13H,3-8H2,1-2H3.
What are the key properties of [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane?
[1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane has a molecular weight of 250.36 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-hydroxypropan-2-ylsulfamoyl(methyl)amino]cyclohexane is sourced from PubChem (CID 43502138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).