1-(dimethylsulfamoylamino)-2-hydroxyethane

C4H12N2O3S — CID 3657512

IUPAC1-(dimethylsulfamoylamino)-2-hydroxyethane
SMILESCN(C)S(=O)(=O)NCCO
InChIInChI=1S/C4H12N2O3S/c1-6(2)10(8,9)5-3-4-7/h5,7H,3-4H2,1-2H3
InChIKeyKZPGKVAAISIIFE-UHFFFAOYSA-N
MW168.22 g/mol
LogP-1.63
Rot. Bonds4

About 1-(dimethylsulfamoylamino)-2-hydroxyethane

1-(dimethylsulfamoylamino)-2-hydroxyethane (PubChem CID 3657512) has the molecular formula C4H12N2O3S and a molecular weight of 168.22 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-2-hydroxyethane.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-2-hydroxyethane
PubChem CID3657512
Molecular FormulaC4H12N2O3S
Molecular Weight168.22 g/mol
Exact Mass168.06
IUPAC Name1-(dimethylsulfamoylamino)-2-hydroxyethane
SMILESCN(C)S(=O)(=O)NCCO
InChIInChI=1S/C4H12N2O3S/c1-6(2)10(8,9)5-3-4-7/h5,7H,3-4H2,1-2H3
InChIKeyKZPGKVAAISIIFE-UHFFFAOYSA-N
XLogP-1.63
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 5-1.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-2-hydroxyethane?
The IUPAC name of 1-(dimethylsulfamoylamino)-2-hydroxyethane (CID 3657512) is 1-(dimethylsulfamoylamino)-2-hydroxyethane.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-2-hydroxyethane?
The canonical SMILES for 1-(dimethylsulfamoylamino)-2-hydroxyethane is CN(C)S(=O)(=O)NCCO.
What is the InChIKey of 1-(dimethylsulfamoylamino)-2-hydroxyethane?
The InChIKey is KZPGKVAAISIIFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O3S/c1-6(2)10(8,9)5-3-4-7/h5,7H,3-4H2,1-2H3.
What are the key properties of 1-(dimethylsulfamoylamino)-2-hydroxyethane?
1-(dimethylsulfamoylamino)-2-hydroxyethane has a molecular weight of 168.22 g/mol, XLogP of -1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-2-hydroxyethane is sourced from PubChem (CID 3657512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).