5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide

C14H25NO2S2 — CID 60530946

IUPAC5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NC(C)(C)CC(C)(C)C)s1
InChIInChI=1S/C14H25NO2S2/c1-7-11-8-9-12(18-11)19(16,17)15-14(5,6)10-13(2,3)4/h8-9,15H,7,10H2,1-6H3
InChIKeyWKCFFDNZMJUMRU-UHFFFAOYSA-N
MW303.49 g/mol
LogP3.80
Rot. Bonds5

About 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide

5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide (PubChem CID 60530946) has the molecular formula C14H25NO2S2 and a molecular weight of 303.49 g/mol. Its IUPAC name is 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide
PubChem CID60530946
Molecular FormulaC14H25NO2S2
Molecular Weight303.49 g/mol
Exact Mass303.13
IUPAC Name5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NC(C)(C)CC(C)(C)C)s1
InChIInChI=1S/C14H25NO2S2/c1-7-11-8-9-12(18-11)19(16,17)15-14(5,6)10-13(2,3)4/h8-9,15H,7,10H2,1-6H3
InChIKeyWKCFFDNZMJUMRU-UHFFFAOYSA-N
XLogP3.80
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.49
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)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

5-(2,4,4-trimethylpentan-2-ylsulfamoyl)thiophene-2-carboxylic acid
CID 61027668
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(1-bromo-2-phenylpropan-2-yl)-5-ethylthiophene-2-sulfonamide
CID 105060223
N-cyclopropyl-5-ethylthiophene-2-sulfonamide
CID 61061009
5-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61059652
N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-2-yl]-5-ethylthiophene-2-sulfonamide
CID 56511437
5-ethyl-N-(4-iodophenyl)thiophene-2-sulfonamide
CID 47309223
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
5-bromo-N-(2-methylbutan-2-yl)thiophene-2-sulfonamide
CID 19682083
5-[(cyclopropylamino)methyl]-N-(2-methylpentan-2-yl)thiophene-2-sulfonamide
CID 106079469
5-[2-(ethylamino)ethyl]-N-(1-methoxy-2-methylpropan-2-yl)thiophene-2-sulfonamide
CID 106080577
5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
CID 110664046

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide (CID 60530946) is 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NC(C)(C)CC(C)(C)C)s1.
What is the InChIKey of 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide?
The InChIKey is WKCFFDNZMJUMRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2S2/c1-7-11-8-9-12(18-11)19(16,17)15-14(5,6)10-13(2,3)4/h8-9,15H,7,10H2,1-6H3.
What are the key properties of 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide?
5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide has a molecular weight of 303.49 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2,4,4-trimethylpentan-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 60530946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).