1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane

C11H24N2O3S — CID 43427814

IUPAC1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane
SMILESCCCCN(C)S(=O)(=O)NC1CCC(O)CC1
InChIInChI=1S/C11H24N2O3S/c1-3-4-9-13(2)17(15,16)12-10-5-7-11(14)8-6-10/h10-12,14H,3-9H2,1-2H3
InChIKeyGURVUUWDWFOSRO-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.86
Rot. Bonds6

About 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane

1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane (PubChem CID 43427814) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane.

Molecular Properties

Compound Name1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane
PubChem CID43427814
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane
SMILESCCCCN(C)S(=O)(=O)NC1CCC(O)CC1
InChIInChI=1S/C11H24N2O3S/c1-3-4-9-13(2)17(15,16)12-10-5-7-11(14)8-6-10/h10-12,14H,3-9H2,1-2H3
InChIKeyGURVUUWDWFOSRO-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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Frequently Asked Questions

What is the IUPAC name of 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane?
The IUPAC name of 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane (CID 43427814) is 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane.
What is the SMILES notation for 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane?
The canonical SMILES for 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane is CCCCN(C)S(=O)(=O)NC1CCC(O)CC1.
What is the InChIKey of 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane?
The InChIKey is GURVUUWDWFOSRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-3-4-9-13(2)17(15,16)12-10-5-7-11(14)8-6-10/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane?
1-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane 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-[[butyl(methyl)sulfamoyl]amino]-4-hydroxycyclohexane is sourced from PubChem (CID 43427814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).