4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol

C10H21NO3S — CID 114762645

IUPAC4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol
SMILESCN(CCS(C)(=O)=O)C1CCC(O)CC1
InChIInChI=1S/C10H21NO3S/c1-11(7-8-15(2,13)14)9-3-5-10(12)6-4-9/h9-10,12H,3-8H2,1-2H3
InChIKeyOMLPADCUOLKPQL-UHFFFAOYSA-N
MW235.35 g/mol
LogP0.27
Rot. Bonds4

About 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol

4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol (PubChem CID 114762645) has the molecular formula C10H21NO3S and a molecular weight of 235.35 g/mol. Its IUPAC name is 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol
PubChem CID114762645
Molecular FormulaC10H21NO3S
Molecular Weight235.35 g/mol
Exact Mass235.12
IUPAC Name4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol
SMILESCN(CCS(C)(=O)=O)C1CCC(O)CC1
InChIInChI=1S/C10H21NO3S/c1-11(7-8-15(2,13)14)9-3-5-10(12)6-4-9/h9-10,12H,3-8H2,1-2H3
InChIKeyOMLPADCUOLKPQL-UHFFFAOYSA-N
XLogP0.27
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-Propan-2-ylsulfonylethylamino)cyclohexan-1-ol
CID 57992763
4-(2-Methylsulfonylethylamino)cyclohexan-1-ol
CID 70946592
N-(4-hydroxycyclohexyl)-N-methylmethanesulfonamide
CID 71189096
4-(1,1-Dioxo-1,4-thiazinan-4-yl)cyclohexan-1-ol
CID 104549120
4-(1,1-Dioxo-1,3-thiazolidin-3-yl)cyclohexan-1-ol
CID 176696804
1-[Cyclohexyl(2-methylsulfonylethyl)amino]propan-2-ol
CID 60260853
[1-(2-Methylsulfonylethyl)piperidin-2-yl]methanol
CID 60967180
4-(1-Methylsulfonylpropan-2-ylamino)cyclohexan-1-ol
CID 64630099
4-[(2-Methylsulfonylcyclopentyl)amino]cyclohexan-1-ol
CID 65046328
3-[Methyl(2-methylsulfonylethyl)amino]cyclopentan-1-ol
CID 79849773
6-[Methyl(2-methylsulfonylethyl)amino]hexan-2-ol
CID 79849774
5-[Methyl(2-methylsulfonylethyl)amino]pentan-2-ol
CID 79849954

Frequently Asked Questions

What is the IUPAC name of 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol (CID 114762645) is 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol is CN(CCS(C)(=O)=O)C1CCC(O)CC1.
What is the InChIKey of 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol?
The InChIKey is OMLPADCUOLKPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3S/c1-11(7-8-15(2,13)14)9-3-5-10(12)6-4-9/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol?
4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol has a molecular weight of 235.35 g/mol, XLogP of 0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 114762645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).