1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane

C6H16N2O3S — CID 65113389

IUPAC1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane
SMILESCN(C)S(=O)(=O)NCC(C)(C)O
InChIInChI=1S/C6H16N2O3S/c1-6(2,9)5-7-12(10,11)8(3)4/h7,9H,5H2,1-4H3
InChIKeyBHOOQGCSCPVABY-UHFFFAOYSA-N
MW196.27 g/mol
LogP-0.85
Rot. Bonds4

About 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane

1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane (PubChem CID 65113389) has the molecular formula C6H16N2O3S and a molecular weight of 196.27 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane
PubChem CID65113389
Molecular FormulaC6H16N2O3S
Molecular Weight196.27 g/mol
Exact Mass196.09
IUPAC Name1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane
SMILESCN(C)S(=O)(=O)NCC(C)(C)O
InChIInChI=1S/C6H16N2O3S/c1-6(2,9)5-7-12(10,11)8(3)4/h7,9H,5H2,1-4H3
InChIKeyBHOOQGCSCPVABY-UHFFFAOYSA-N
XLogP-0.85
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane?
The IUPAC name of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane (CID 65113389) is 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane?
The canonical SMILES for 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane is CN(C)S(=O)(=O)NCC(C)(C)O.
What is the InChIKey of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane?
The InChIKey is BHOOQGCSCPVABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2O3S/c1-6(2,9)5-7-12(10,11)8(3)4/h7,9H,5H2,1-4H3.
What are the key properties of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane?
1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane has a molecular weight of 196.27 g/mol, XLogP of -0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpropane is sourced from PubChem (CID 65113389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).