4-methyl-1,2-thiazolidine 1,1-dioxide

C4H9NO2S — CID 59155177

IUPAC4-methyl-1,2-thiazolidine 1,1-dioxide
SMILESCC1CNS(=O)(=O)C1
InChIInChI=1S/C4H9NO2S/c1-4-2-5-8(6,7)3-4/h4-5H,2-3H2,1H3
InChIKeyZJNXUAJQNBXKSL-UHFFFAOYSA-N
MW135.19 g/mol
LogP-0.44
Rot. Bonds

About 4-methyl-1,2-thiazolidine 1,1-dioxide

4-methyl-1,2-thiazolidine 1,1-dioxide (PubChem CID 59155177) has the molecular formula C4H9NO2S and a molecular weight of 135.19 g/mol. Its IUPAC name is 4-methyl-1,2-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name4-methyl-1,2-thiazolidine 1,1-dioxide
PubChem CID59155177
Molecular FormulaC4H9NO2S
Molecular Weight135.19 g/mol
Exact Mass135.04
IUPAC Name4-methyl-1,2-thiazolidine 1,1-dioxide
SMILESCC1CNS(=O)(=O)C1
InChIInChI=1S/C4H9NO2S/c1-4-2-5-8(6,7)3-4/h4-5H,2-3H2,1H3
InChIKeyZJNXUAJQNBXKSL-UHFFFAOYSA-N
XLogP-0.44
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.19
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 4-methyl-1,2-thiazolidine 1,1-dioxide (CID 59155177) is 4-methyl-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 4-methyl-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 4-methyl-1,2-thiazolidine 1,1-dioxide is CC1CNS(=O)(=O)C1.
What is the InChIKey of 4-methyl-1,2-thiazolidine 1,1-dioxide?
The InChIKey is ZJNXUAJQNBXKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2S/c1-4-2-5-8(6,7)3-4/h4-5H,2-3H2,1H3.
What are the key properties of 4-methyl-1,2-thiazolidine 1,1-dioxide?
4-methyl-1,2-thiazolidine 1,1-dioxide has a molecular weight of 135.19 g/mol, XLogP of -0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 59155177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).