5-(4-ethoxyphenyl)thiophene-2-sulfonamide

C12H13NO3S2 — CID 121010461

IUPAC5-(4-ethoxyphenyl)thiophene-2-sulfonamide
SMILESCCOc1ccc(-c2ccc(S(N)(=O)=O)s2)cc1
InChIInChI=1S/C12H13NO3S2/c1-2-16-10-5-3-9(4-6-10)11-7-8-12(17-11)18(13,14)15/h3-8H,2H2,1H3,(H2,13,14,15)
InChIKeyQOZIIRWXCWWDHK-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.46
Rot. Bonds4

About 5-(4-ethoxyphenyl)thiophene-2-sulfonamide

5-(4-ethoxyphenyl)thiophene-2-sulfonamide (PubChem CID 121010461) has the molecular formula C12H13NO3S2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)thiophene-2-sulfonamide
PubChem CID121010461
Molecular FormulaC12H13NO3S2
Molecular Weight283.37 g/mol
Exact Mass283.03
IUPAC Name5-(4-ethoxyphenyl)thiophene-2-sulfonamide
SMILESCCOc1ccc(-c2ccc(S(N)(=O)=O)s2)cc1
InChIInChI=1S/C12H13NO3S2/c1-2-16-10-5-3-9(4-6-10)11-7-8-12(17-11)18(13,14)15/h3-8H,2H2,1H3,(H2,13,14,15)
InChIKeyQOZIIRWXCWWDHK-UHFFFAOYSA-N
XLogP2.46
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-ethoxyphenyl)thiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-bis(4-ethoxyphenyl)thiophene
CID 154402016
2-amino-1-[5-(4-ethoxyphenyl)thiophen-2-yl]ethanone
CID 94273700
(2R)-2-[[5-(4-ethoxyphenyl)thiophen-2-yl]sulfonyl-methylamino]-2-(1-propan-2-yloxycarbonylpiperidin-4-yl)acetic acid
CID 68566668
3-[5-chloro-1-[5-(4-ethoxyphenyl)thiophen-2-yl]sulfonylindol-3-yl]propanoic acid
CID 58838249
4-(4-ethoxyphenyl)benzenesulfonic acid
CID 87969611
(2R)-2-[[5-(4-ethoxyphenyl)thiophen-2-yl]sulfonyl-propylamino]-2-(1-propan-2-yloxycarbonylpiperidin-4-yl)acetic acid
CID 68568006
(4-ethoxyphenyl) 3-sulfamoylbenzenesulfonate
CID 31066756
4-(5-ethylsulfonylthiophen-2-yl)benzaldehyde
CID 89084894
2-(4-sulfamoylphenoxy)ethyl 5-(4-fluorophenyl)thiophene-2-carboxylate
CID 46608934
N-benzyl-5-(4-ethoxyphenyl)thiophene-2-carboxamide
CID 46083104
N,N-dibenzyl-5-(4-ethoxyphenyl)thiophene-2-carboxamide
CID 46082653
1-ethoxy-4-ethylsulfonylbenzene
CID 12846221

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(4-ethoxyphenyl)thiophene-2-sulfonamide (CID 121010461) is 5-(4-ethoxyphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(4-ethoxyphenyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(4-ethoxyphenyl)thiophene-2-sulfonamide is CCOc1ccc(-c2ccc(S(N)(=O)=O)s2)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)thiophene-2-sulfonamide?
The InChIKey is QOZIIRWXCWWDHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3S2/c1-2-16-10-5-3-9(4-6-10)11-7-8-12(17-11)18(13,14)15/h3-8H,2H2,1H3,(H2,13,14,15).
What are the key properties of 5-(4-ethoxyphenyl)thiophene-2-sulfonamide?
5-(4-ethoxyphenyl)thiophene-2-sulfonamide has a molecular weight of 283.37 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 121010461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).