5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide

C6H10N2O3S2 — CID 15077123

IUPAC5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide
SMILESCCOc1sc(C)nc1S(N)(=O)=O
InChIInChI=1S/C6H10N2O3S2/c1-3-11-6-5(13(7,9)10)8-4(2)12-6/h3H2,1-2H3,(H2,7,9,10)
InChIKeyQSLLCGUQMYAEOU-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.50
Rot. Bonds3

About 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide

5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide (PubChem CID 15077123) has the molecular formula C6H10N2O3S2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide.

Molecular Properties

Compound Name5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide
PubChem CID15077123
Molecular FormulaC6H10N2O3S2
Molecular Weight222.29 g/mol
Exact Mass222.01
IUPAC Name5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide
SMILESCCOc1sc(C)nc1S(N)(=O)=O
InChIInChI=1S/C6H10N2O3S2/c1-3-11-6-5(13(7,9)10)8-4(2)12-6/h3H2,1-2H3,(H2,7,9,10)
InChIKeyQSLLCGUQMYAEOU-UHFFFAOYSA-N
XLogP0.50
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide?
The IUPAC name of 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide (CID 15077123) is 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide.
What is the SMILES notation for 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide?
The canonical SMILES for 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide is CCOc1sc(C)nc1S(N)(=O)=O.
What is the InChIKey of 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide?
The InChIKey is QSLLCGUQMYAEOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3S2/c1-3-11-6-5(13(7,9)10)8-4(2)12-6/h3H2,1-2H3,(H2,7,9,10).
What are the key properties of 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide?
5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide has a molecular weight of 222.29 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-methyl-1,3-thiazole-4-sulfonamide is sourced from PubChem (CID 15077123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).