1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol

C7H18N2O3S — CID 79387046

IUPAC1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol
SMILESCN(C)S(=O)(=O)N(C)CC(C)(C)O
InChIInChI=1S/C7H18N2O3S/c1-7(2,10)6-9(5)13(11,12)8(3)4/h10H,6H2,1-5H3
InChIKeyNCCHESGESLOHFJ-UHFFFAOYSA-N
MW210.30 g/mol
LogP-0.50
Rot. Bonds4

About 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol

1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol (PubChem CID 79387046) has the molecular formula C7H18N2O3S and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol
PubChem CID79387046
Molecular FormulaC7H18N2O3S
Molecular Weight210.30 g/mol
Exact Mass210.10
IUPAC Name1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol
SMILESCN(C)S(=O)(=O)N(C)CC(C)(C)O
InChIInChI=1S/C7H18N2O3S/c1-7(2,10)6-9(5)13(11,12)8(3)4/h10H,6H2,1-5H3
InChIKeyNCCHESGESLOHFJ-UHFFFAOYSA-N
XLogP-0.50
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol (CID 79387046) is 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol is CN(C)S(=O)(=O)N(C)CC(C)(C)O.
What is the InChIKey of 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol?
The InChIKey is NCCHESGESLOHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O3S/c1-7(2,10)6-9(5)13(11,12)8(3)4/h10H,6H2,1-5H3.
What are the key properties of 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol?
1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol has a molecular weight of 210.30 g/mol, XLogP of -0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dimethylsulfamoyl(methyl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 79387046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).