3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane

C6H14N2O4S — CID 107268641

IUPAC3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane
SMILESCC1OCCC1(O)CNS(N)(=O)=O
InChIInChI=1S/C6H14N2O4S/c1-5-6(9,2-3-12-5)4-8-13(7,10)11/h5,8-9H,2-4H2,1H3,(H2,7,10,11)
InChIKeyWWMSTCVWQHGKRA-UHFFFAOYSA-N
MW210.25 g/mol
LogP-1.68
Rot. Bonds3

About 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane

3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane (PubChem CID 107268641) has the molecular formula C6H14N2O4S and a molecular weight of 210.25 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane.

Molecular Properties

Compound Name3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane
PubChem CID107268641
Molecular FormulaC6H14N2O4S
Molecular Weight210.25 g/mol
Exact Mass210.07
IUPAC Name3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane
SMILESCC1OCCC1(O)CNS(N)(=O)=O
InChIInChI=1S/C6H14N2O4S/c1-5-6(9,2-3-12-5)4-8-13(7,10)11/h5,8-9H,2-4H2,1H3,(H2,7,10,11)
InChIKeyWWMSTCVWQHGKRA-UHFFFAOYSA-N
XLogP-1.68
TPSA101.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 5-1.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(dimethylsulfamoylamino)methyl]-3-hydroxy-2-methyloxolane
CID 107271476
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]morpholine-4-sulfonamide
CID 107271464
4-amino-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzenesulfonamide
CID 107271459
2-methyl-3-[(1-methylsulfonylpropan-2-ylamino)methyl]oxolan-3-ol
CID 107270852
3-[(2-ethylsulfonylethylamino)methyl]-2-methyloxolan-3-ol
CID 106101245
2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]propanamide
CID 106101086
1-cyano-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]propane-1-sulfonamide
CID 107271483
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-2-methylsulfonylpropanamide
CID 107302161
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]acetamide
CID 107302191
4-[1-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]ethyl]benzenesulfonamide
CID 107270686
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

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane?
The IUPAC name of 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane (CID 107268641) is 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane.
What is the SMILES notation for 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane?
The canonical SMILES for 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane is CC1OCCC1(O)CNS(N)(=O)=O.
What is the InChIKey of 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane?
The InChIKey is WWMSTCVWQHGKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O4S/c1-5-6(9,2-3-12-5)4-8-13(7,10)11/h5,8-9H,2-4H2,1H3,(H2,7,10,11).
What are the key properties of 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane?
3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane has a molecular weight of 210.25 g/mol, XLogP of -1.68, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane is sourced from PubChem (CID 107268641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).