5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide

C14H17NO3S2 — CID 61454703

IUPAC5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(C(C)O)cc2)s1
InChIInChI=1S/C14H17NO3S2/c1-3-13-8-9-14(19-13)20(17,18)15-12-6-4-11(5-7-12)10(2)16/h4-10,15-16H,3H2,1-2H3
InChIKeyOZTBORNTAKLMEL-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.16
Rot. Bonds5

About 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide

5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide (PubChem CID 61454703) has the molecular formula C14H17NO3S2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
PubChem CID61454703
Molecular FormulaC14H17NO3S2
Molecular Weight311.43 g/mol
Exact Mass311.06
IUPAC Name5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(C(C)O)cc2)s1
InChIInChI=1S/C14H17NO3S2/c1-3-13-8-9-14(19-13)20(17,18)15-12-6-4-11(5-7-12)10(2)16/h4-10,15-16H,3H2,1-2H3
InChIKeyOZTBORNTAKLMEL-UHFFFAOYSA-N
XLogP3.16
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-(4-iodophenyl)thiophene-2-sulfonamide
CID 47309223
5-ethyl-N-(4-methoxyphenyl)thiophene-2-sulfonamide
CID 47309103
N-(4-cyanophenyl)-5-ethylthiophene-2-sulfonamide
CID 47309319
N-(3,4-dimethylphenyl)-5-ethylthiophene-2-sulfonamide
CID 47308966
N-[[5-[(4-butan-2-ylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553889
N-[3-(1-aminoethyl)phenyl]-5-ethylthiophene-2-sulfonamide
CID 61454557
N-(3,5-dichlorophenyl)-5-ethylthiophene-2-sulfonamide
CID 113098917
N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 43416696
5-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61059652
N-(4-amino-3-methylphenyl)-5-ethylthiophene-2-sulfonamide
CID 54984022
5-ethyl-N-(4-morpholin-4-ylphenyl)thiophene-2-sulfonamide
CID 112981153
N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
CID 113231899

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide (CID 61454703) is 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(C(C)O)cc2)s1.
What is the InChIKey of 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is OZTBORNTAKLMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO3S2/c1-3-13-8-9-14(19-13)20(17,18)15-12-6-4-11(5-7-12)10(2)16/h4-10,15-16H,3H2,1-2H3.
What are the key properties of 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide?
5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 311.43 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 61454703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).