(dimethylsulfamoylamino)ethane

C4H12N2O2S — CID 4635397

IUPAC(dimethylsulfamoylamino)ethane
SMILESCCNS(=O)(=O)N(C)C
InChIInChI=1S/C4H12N2O2S/c1-4-5-9(7,8)6(2)3/h5H,4H2,1-3H3
InChIKeyPBETWEDFWXYCJP-UHFFFAOYSA-N
MW152.22 g/mol
LogP-0.60
Rot. Bonds3

About (dimethylsulfamoylamino)ethane

(dimethylsulfamoylamino)ethane (PubChem CID 4635397) has the molecular formula C4H12N2O2S and a molecular weight of 152.22 g/mol. Its IUPAC name is (dimethylsulfamoylamino)ethane.

Molecular Properties

Compound Name(dimethylsulfamoylamino)ethane
PubChem CID4635397
Molecular FormulaC4H12N2O2S
Molecular Weight152.22 g/mol
Exact Mass152.06
IUPAC Name(dimethylsulfamoylamino)ethane
SMILESCCNS(=O)(=O)N(C)C
InChIInChI=1S/C4H12N2O2S/c1-4-5-9(7,8)6(2)3/h5H,4H2,1-3H3
InChIKeyPBETWEDFWXYCJP-UHFFFAOYSA-N
XLogP-0.60
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.22
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (dimethylsulfamoylamino)ethane?
The IUPAC name of (dimethylsulfamoylamino)ethane (CID 4635397) is (dimethylsulfamoylamino)ethane.
What is the SMILES notation for (dimethylsulfamoylamino)ethane?
The canonical SMILES for (dimethylsulfamoylamino)ethane is CCNS(=O)(=O)N(C)C.
What is the InChIKey of (dimethylsulfamoylamino)ethane?
The InChIKey is PBETWEDFWXYCJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O2S/c1-4-5-9(7,8)6(2)3/h5H,4H2,1-3H3.
What are the key properties of (dimethylsulfamoylamino)ethane?
(dimethylsulfamoylamino)ethane has a molecular weight of 152.22 g/mol, XLogP of -0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (dimethylsulfamoylamino)ethane is sourced from PubChem (CID 4635397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).