5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide

C19H20N2O3S2 — CID 112987399

IUPAC5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3OC)cc2)s1
InChIInChI=1S/C19H20N2O3S2/c1-3-16-12-13-19(25-16)26(22,23)21-15-10-8-14(9-11-15)20-17-6-4-5-7-18(17)24-2/h4-13,20-21H,3H2,1-2H3
InChIKeyOGOFSOUKAXJSNA-UHFFFAOYSA-N
MW388.51 g/mol
LogP4.86
Rot. Bonds7

About 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide

5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide (PubChem CID 112987399) has the molecular formula C19H20N2O3S2 and a molecular weight of 388.51 g/mol. Its IUPAC name is 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide
PubChem CID112987399
Molecular FormulaC19H20N2O3S2
Molecular Weight388.51 g/mol
Exact Mass388.09
IUPAC Name5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3OC)cc2)s1
InChIInChI=1S/C19H20N2O3S2/c1-3-16-12-13-19(25-16)26(22,23)21-15-10-8-14(9-11-15)20-17-6-4-5-7-18(17)24-2/h4-13,20-21H,3H2,1-2H3
InChIKeyOGOFSOUKAXJSNA-UHFFFAOYSA-N
XLogP4.86
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.51
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethyl-N-(4-methoxyphenyl)thiophene-2-sulfonamide
CID 47309103
5-ethyl-N-(4-iodophenyl)thiophene-2-sulfonamide
CID 47309223
N-(5-amino-2-methoxyphenyl)-5-ethylthiophene-2-sulfonamide
CID 61454236
N-(3,4-dimethylphenyl)-5-ethylthiophene-2-sulfonamide
CID 47308966
5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide
CID 87031963
N-(4-cyanophenyl)-5-ethylthiophene-2-sulfonamide
CID 47309319
N-[4-(3-cyanoanilino)phenyl]-5-ethylthiophene-2-sulfonamide
CID 112990004
N-[2-(aminomethyl)phenyl]-5-ethylthiophene-2-sulfonamide
CID 64894286
5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 61454703
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-5-ethylthiophene-2-sulfonamide
CID 113017331
N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
CID 113231899
4-acetyl-N-[4-(2-methoxyanilino)phenyl]benzenesulfonamide
CID 2465106

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide (CID 112987399) is 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3OC)cc2)s1.
What is the InChIKey of 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide?
The InChIKey is OGOFSOUKAXJSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S2/c1-3-16-12-13-19(25-16)26(22,23)21-15-10-8-14(9-11-15)20-17-6-4-5-7-18(17)24-2/h4-13,20-21H,3H2,1-2H3.
What are the key properties of 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide?
5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide has a molecular weight of 388.51 g/mol, XLogP of 4.86, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[4-(2-methoxyanilino)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 112987399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).