5,5-dimethyl-1,2-thiazolidine 1,1-dioxide

C5H11NO2S — CID 86702155

IUPAC5,5-dimethyl-1,2-thiazolidine 1,1-dioxide
SMILESCC1(C)CCNS1(=O)=O
InChIInChI=1S/C5H11NO2S/c1-5(2)3-4-6-9(5,7)8/h6H,3-4H2,1-2H3
InChIKeyKWXZHEYNEMPUKK-UHFFFAOYSA-N
MW149.22 g/mol
LogP0.09
Rot. Bonds

About 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide

5,5-dimethyl-1,2-thiazolidine 1,1-dioxide (PubChem CID 86702155) has the molecular formula C5H11NO2S and a molecular weight of 149.22 g/mol. Its IUPAC name is 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name5,5-dimethyl-1,2-thiazolidine 1,1-dioxide
PubChem CID86702155
Molecular FormulaC5H11NO2S
Molecular Weight149.22 g/mol
Exact Mass149.05
IUPAC Name5,5-dimethyl-1,2-thiazolidine 1,1-dioxide
SMILESCC1(C)CCNS1(=O)=O
InChIInChI=1S/C5H11NO2S/c1-5(2)3-4-6-9(5,7)8/h6H,3-4H2,1-2H3
InChIKeyKWXZHEYNEMPUKK-UHFFFAOYSA-N
XLogP0.09
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.22
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide (CID 86702155) is 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide is CC1(C)CCNS1(=O)=O.
What is the InChIKey of 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide?
The InChIKey is KWXZHEYNEMPUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2S/c1-5(2)3-4-6-9(5,7)8/h6H,3-4H2,1-2H3.
What are the key properties of 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide?
5,5-dimethyl-1,2-thiazolidine 1,1-dioxide has a molecular weight of 149.22 g/mol, XLogP of 0.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 86702155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).