5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide

C12H15NO2S3 — CID 110870567

IUPAC5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NC(C)(C)c2cccs2)s1
InChIInChI=1S/C12H15NO2S3/c1-9-6-7-11(17-9)18(14,15)13-12(2,3)10-5-4-8-16-10/h4-8,13H,1-3H3
InChIKeyULKQJAJVEJKOCL-UHFFFAOYSA-N
MW301.46 g/mol
LogP3.33
Rot. Bonds4

About 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide

5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide (PubChem CID 110870567) has the molecular formula C12H15NO2S3 and a molecular weight of 301.46 g/mol. Its IUPAC name is 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide
PubChem CID110870567
Molecular FormulaC12H15NO2S3
Molecular Weight301.46 g/mol
Exact Mass301.03
IUPAC Name5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NC(C)(C)c2cccs2)s1
InChIInChI=1S/C12H15NO2S3/c1-9-6-7-11(17-9)18(14,15)13-12(2,3)10-5-4-8-16-10/h4-8,13H,1-3H3
InChIKeyULKQJAJVEJKOCL-UHFFFAOYSA-N
XLogP3.33
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.46
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide (CID 110870567) is 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)NC(C)(C)c2cccs2)s1.
What is the InChIKey of 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide?
The InChIKey is ULKQJAJVEJKOCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2S3/c1-9-6-7-11(17-9)18(14,15)13-12(2,3)10-5-4-8-16-10/h4-8,13H,1-3H3.
What are the key properties of 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide?
5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide has a molecular weight of 301.46 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 110870567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).