[3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol

C11H23NO4S — CID 79858292

IUPAC[3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol
SMILESCN(CCS(C)(=O)=O)CC1(CO)CCCOC1
InChIInChI=1S/C11H23NO4S/c1-12(5-7-17(2,14)15)8-11(9-13)4-3-6-16-10-11/h13H,3-10H2,1-2H3
InChIKeySIHPEZJFJBMOJW-UHFFFAOYSA-N
MW265.37 g/mol
LogP-0.25
Rot. Bonds6

About [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol

[3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol (PubChem CID 79858292) has the molecular formula C11H23NO4S and a molecular weight of 265.37 g/mol. Its IUPAC name is [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol.

Molecular Properties

Compound Name[3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol
PubChem CID79858292
Molecular FormulaC11H23NO4S
Molecular Weight265.37 g/mol
Exact Mass265.13
IUPAC Name[3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol
SMILESCN(CCS(C)(=O)=O)CC1(CO)CCCOC1
InChIInChI=1S/C11H23NO4S/c1-12(5-7-17(2,14)15)8-11(9-13)4-3-6-16-10-11/h13H,3-10H2,1-2H3
InChIKeySIHPEZJFJBMOJW-UHFFFAOYSA-N
XLogP-0.25
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-[[cyclopropylmethyl(methyl)amino]methyl]oxan-3-yl]methanol
CID 63747612
[3-(3-ethylsulfonylpropyl)oxan-3-yl]methanol
CID 66059232
[3-[[ethyl(propyl)amino]methyl]oxan-3-yl]methanol
CID 63747610
[3-[[methyl(thiophen-3-ylmethyl)amino]methyl]oxan-3-yl]methanol
CID 55241090
[3-[(dimethylamino)methyl]oxolan-3-yl]methanol
CID 62270559
1-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79859219
[3-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]oxan-3-yl]methanol
CID 63745746
[3-[[butyl(ethyl)amino]methyl]oxan-3-yl]methanol
CID 63746410
[3-[[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]methyl]oxan-3-yl]methanol
CID 63746094
2-methyl-N-[[1-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexyl]methyl]propan-2-amine
CID 79842792
1-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclobutan-1-amine
CID 81170494
2-[1-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclopropyl]acetonitrile
CID 79850636

Frequently Asked Questions

What is the IUPAC name of [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol?
The IUPAC name of [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol (CID 79858292) is [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol.
What is the SMILES notation for [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol?
The canonical SMILES for [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol is CN(CCS(C)(=O)=O)CC1(CO)CCCOC1.
What is the InChIKey of [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol?
The InChIKey is SIHPEZJFJBMOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO4S/c1-12(5-7-17(2,14)15)8-11(9-13)4-3-6-16-10-11/h13H,3-10H2,1-2H3.
What are the key properties of [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol?
[3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol has a molecular weight of 265.37 g/mol, XLogP of -0.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[methyl(2-methylsulfonylethyl)amino]methyl]oxan-3-yl]methanol is sourced from PubChem (CID 79858292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).