3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane

C8H18N2O4S — CID 107271476

IUPAC3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane
SMILESCC1OCCC1(O)CNS(=O)(=O)N(C)C
InChIInChI=1S/C8H18N2O4S/c1-7-8(11,4-5-14-7)6-9-15(12,13)10(2)3/h7,9,11H,4-6H2,1-3H3
InChIKeyYBRBTDJLQOCDBB-UHFFFAOYSA-N
MW238.31 g/mol
LogP-1.08
Rot. Bonds4

About 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane

3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane (PubChem CID 107271476) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane.

Molecular Properties

Compound Name3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane
PubChem CID107271476
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC Name3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane
SMILESCC1OCCC1(O)CNS(=O)(=O)N(C)C
InChIInChI=1S/C8H18N2O4S/c1-7-8(11,4-5-14-7)6-9-15(12,13)10(2)3/h7,9,11H,4-6H2,1-3H3
InChIKeyYBRBTDJLQOCDBB-UHFFFAOYSA-N
XLogP-1.08
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-1.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane
CID 107268641
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]morpholine-4-sulfonamide
CID 107271464
3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-1,1-dimethylurea
CID 107268631
3-[(2-ethylsulfonylethylamino)methyl]-2-methyloxolan-3-ol
CID 106101245
1-cyano-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]propane-1-sulfonamide
CID 107271483
4-amino-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzenesulfonamide
CID 107271459
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]acetamide
CID 107302191
1-(4-fluorophenyl)-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]methanesulfonamide
CID 107271549
2,4,6-trifluoro-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzenesulfonamide
CID 107271538
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-5-methylthiophene-2-sulfonamide
CID 107271510
2-methyl-3-[(1-methylsulfonylpropan-2-ylamino)methyl]oxolan-3-ol
CID 107270852
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-2-methylsulfonylpropanamide
CID 107302161

Frequently Asked Questions

What is the IUPAC name of 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane?
The IUPAC name of 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane (CID 107271476) is 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane.
What is the SMILES notation for 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane?
The canonical SMILES for 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane is CC1OCCC1(O)CNS(=O)(=O)N(C)C.
What is the InChIKey of 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane?
The InChIKey is YBRBTDJLQOCDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-7-8(11,4-5-14-7)6-9-15(12,13)10(2)3/h7,9,11H,4-6H2,1-3H3.
What are the key properties of 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane?
3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane has a molecular weight of 238.31 g/mol, XLogP of -1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane is sourced from PubChem (CID 107271476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).