2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide

C6H14N2O3S — CID 117026529

IUPAC2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide
SMILESCOCCN1CCN(C)S1(=O)=O
InChIInChI=1S/C6H14N2O3S/c1-7-3-4-8(5-6-11-2)12(7,9)10/h3-6H2,1-2H3
InChIKeyZZXQCOGDZSQLLC-UHFFFAOYSA-N
MW194.26 g/mol
LogP-0.88
Rot. Bonds3

About 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide

2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide (PubChem CID 117026529) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide.

Molecular Properties

Compound Name2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide
PubChem CID117026529
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide
SMILESCOCCN1CCN(C)S1(=O)=O
InChIInChI=1S/C6H14N2O3S/c1-7-3-4-8(5-6-11-2)12(7,9)10/h3-6H2,1-2H3
InChIKeyZZXQCOGDZSQLLC-UHFFFAOYSA-N
XLogP-0.88
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-0.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
The IUPAC name of 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide (CID 117026529) is 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide.
What is the SMILES notation for 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
The canonical SMILES for 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide is COCCN1CCN(C)S1(=O)=O.
What is the InChIKey of 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
The InChIKey is ZZXQCOGDZSQLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-7-3-4-8(5-6-11-2)12(7,9)10/h3-6H2,1-2H3.
What are the key properties of 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide has a molecular weight of 194.26 g/mol, XLogP of -0.88, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide is sourced from PubChem (CID 117026529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).