5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide

C9H13NO3S2 — CID 64994375

IUPAC5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC(C)=O)s1
InChIInChI=1S/C9H13NO3S2/c1-3-8-4-5-9(14-8)15(12,13)10-6-7(2)11/h4-5,10H,3,6H2,1-2H3
InChIKeyBHZMZDGWOSKMDY-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.18
Rot. Bonds5

About 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide

5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide (PubChem CID 64994375) has the molecular formula C9H13NO3S2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
PubChem CID64994375
Molecular FormulaC9H13NO3S2
Molecular Weight247.34 g/mol
Exact Mass247.03
IUPAC Name5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC(C)=O)s1
InChIInChI=1S/C9H13NO3S2/c1-3-8-4-5-9(14-8)15(12,13)10-6-7(2)11/h4-5,10H,3,6H2,1-2H3
InChIKeyBHZMZDGWOSKMDY-UHFFFAOYSA-N
XLogP1.18
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
CID 114616513
5-ethyl-N-phenacylthiophene-2-sulfonamide
CID 64993884
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 112996218
N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 112996705
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-fluorophenyl)acetamide
CID 112997718
N-(3,5-dichlorophenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 113001388
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
5-ethyl-N-(2-ethylbutyl)thiophene-2-sulfonamide
CID 115613311
N-cyclopropyl-N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]acetamide
CID 113052210
N-(3-bromopropyl)-5-ethylthiophene-2-sulfonamide
CID 61454391
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 112993027

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide (CID 64994375) is 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCC(C)=O)s1.
What is the InChIKey of 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide?
The InChIKey is BHZMZDGWOSKMDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3S2/c1-3-8-4-5-9(14-8)15(12,13)10-6-7(2)11/h4-5,10H,3,6H2,1-2H3.
What are the key properties of 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide?
5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide has a molecular weight of 247.34 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 64994375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).