5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide

C10H15NO2S2 — CID 114616513

IUPAC5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
SMILESC=C(C)CNS(=O)(=O)c1ccc(CC)s1
InChIInChI=1S/C10H15NO2S2/c1-4-9-5-6-10(14-9)15(12,13)11-7-8(2)3/h5-6,11H,2,4,7H2,1,3H3
InChIKeyCRZDXMXKQUMBGO-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.16
Rot. Bonds5

About 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide

5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide (PubChem CID 114616513) has the molecular formula C10H15NO2S2 and a molecular weight of 245.37 g/mol. Its IUPAC name is 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
PubChem CID114616513
Molecular FormulaC10H15NO2S2
Molecular Weight245.37 g/mol
Exact Mass245.05
IUPAC Name5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
SMILESC=C(C)CNS(=O)(=O)c1ccc(CC)s1
InChIInChI=1S/C10H15NO2S2/c1-4-9-5-6-10(14-9)15(12,13)11-7-8(2)3/h5-6,11H,2,4,7H2,1,3H3
InChIKeyCRZDXMXKQUMBGO-UHFFFAOYSA-N
XLogP2.16
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
CID 64994375
5-(2-methylprop-2-enylsulfamoyl)thiophene-2-carboxylic acid
CID 114615365
5-ethyl-N-phenacylthiophene-2-sulfonamide
CID 64993884
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 112996218
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 112996705
5-ethyl-N-(2-ethylbutyl)thiophene-2-sulfonamide
CID 115613311
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-fluorophenyl)acetamide
CID 112997718
N-(3-bromopropyl)-5-ethylthiophene-2-sulfonamide
CID 61454391
5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide
CID 103835206
N-(3,5-dichlorophenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 113001388

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide (CID 114616513) is 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide is C=C(C)CNS(=O)(=O)c1ccc(CC)s1.
What is the InChIKey of 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide?
The InChIKey is CRZDXMXKQUMBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S2/c1-4-9-5-6-10(14-9)15(12,13)11-7-8(2)3/h5-6,11H,2,4,7H2,1,3H3.
What are the key properties of 5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide?
5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide has a molecular weight of 245.37 g/mol, XLogP of 2.16, 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-methylprop-2-enyl)thiophene-2-sulfonamide is sourced from PubChem (CID 114616513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).