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

C11H24N2O3S — CID 43501625

IUPAC[1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane
SMILESCCC(CO)NS(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C11H24N2O3S/c1-3-10(9-14)12-17(15,16)13(2)11-7-5-4-6-8-11/h10-12,14H,3-9H2,1-2H3
InChIKeyMHLLJXBTTUATIX-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.86
Rot. Bonds6

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

[1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane (PubChem CID 43501625) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane.

Molecular Properties

Compound Name[1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane
PubChem CID43501625
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name[1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane
SMILESCCC(CO)NS(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C11H24N2O3S/c1-3-10(9-14)12-17(15,16)13(2)11-7-5-4-6-8-11/h10-12,14H,3-9H2,1-2H3
InChIKeyMHLLJXBTTUATIX-UHFFFAOYSA-N
XLogP0.86
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[Methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane
CID 103834038
[(3,3-Difluoro-2-hydroxypropyl)sulfamoyl-methylamino]cyclohexane
CID 103836836
N-cyclohexylsulfamate;2-hydroxyethyl(trimethyl)azanium
CID 155093777
N-cyclohexylsulfamate;2-hydroxyethyl(dimethyl)azanium
CID 155684057
1-(Dimethylsulfamoylamino)-4-hydroxycyclohexane
CID 43419371
1-(Dipropylsulfamoylamino)-4-hydroxycyclohexane
CID 43427812
1-[[Butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane
CID 43427814
[3-Hydroxypropylsulfamoyl(methyl)amino]cyclohexane
CID 43501459
N-(3-hydroxypropyl)-2-methylpiperidine-1-sulfonamide
CID 43501570
2-[[Butyl(methyl)sulfamoyl]amino]-1-hydroxybutane
CID 43501669
2-(Dipropylsulfamoylamino)-1-hydroxybutane
CID 43501682
N-(1-hydroxybutan-2-yl)-2-methylpiperidine-1-sulfonamide
CID 43501760

Frequently Asked Questions

What is the IUPAC name of [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane?
The IUPAC name of [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane (CID 43501625) is [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane.
What is the SMILES notation for [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane?
The canonical SMILES for [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane is CCC(CO)NS(=O)(=O)N(C)C1CCCCC1.
What is the InChIKey of [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane?
The InChIKey is MHLLJXBTTUATIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-3-10(9-14)12-17(15,16)13(2)11-7-5-4-6-8-11/h10-12,14H,3-9H2,1-2H3.
What are the key properties of [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane?
[1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane has a molecular weight of 264.39 g/mol, XLogP of 0.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-hydroxybutan-2-ylsulfamoyl(methyl)amino]cyclohexane is sourced from PubChem (CID 43501625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).