5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide

C9H11N3O2S3 — CID 71974673

IUPAC5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2nnc(C)s2)s1
InChIInChI=1S/C9H11N3O2S3/c1-3-7-4-5-8(16-7)17(13,14)12-9-11-10-6(2)15-9/h4-5H,3H2,1-2H3,(H,11,12)
InChIKeyWKVMIKWLIUXYFM-UHFFFAOYSA-N
MW289.41 g/mol
LogP2.27
Rot. Bonds4

About 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide

5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide (PubChem CID 71974673) has the molecular formula C9H11N3O2S3 and a molecular weight of 289.41 g/mol. Its IUPAC name is 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
PubChem CID71974673
Molecular FormulaC9H11N3O2S3
Molecular Weight289.41 g/mol
Exact Mass289.00
IUPAC Name5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2nnc(C)s2)s1
InChIInChI=1S/C9H11N3O2S3/c1-3-7-4-5-8(16-7)17(13,14)12-9-11-10-6(2)15-9/h4-5H,3H2,1-2H3,(H,11,12)
InChIKeyWKVMIKWLIUXYFM-UHFFFAOYSA-N
XLogP2.27
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(propylaminomethyl)thiophene-2-sulfonamide
CID 106082756
5-[(cyclopropylamino)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
CID 106082883
5-ethyl-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 75517993
5-ethyl-N-(4-iodophenyl)thiophene-2-sulfonamide
CID 47309223
N-(3,4-dimethylphenyl)-5-ethylthiophene-2-sulfonamide
CID 47308966
5-ethyl-N-[6-(propan-2-ylamino)pyridazin-3-yl]thiophene-2-sulfonamide
CID 113038015
N-(4-cyanophenyl)-5-ethylthiophene-2-sulfonamide
CID 47309319
2-ethyl-5-(methylaminomethyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
CID 106082921
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
N-cyclopropyl-5-ethylthiophene-2-sulfonamide
CID 61061009
2,4,5-trimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
CID 35538778
5-ethyl-N-(4-methoxyphenyl)thiophene-2-sulfonamide
CID 47309103

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide (CID 71974673) is 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2nnc(C)s2)s1.
What is the InChIKey of 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
The InChIKey is WKVMIKWLIUXYFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2S3/c1-3-7-4-5-8(16-7)17(13,14)12-9-11-10-6(2)15-9/h4-5H,3H2,1-2H3,(H,11,12).
What are the key properties of 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide?
5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide has a molecular weight of 289.41 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 71974673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).