3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide

C11H15ClN2O3S — CID 17225661

IUPAC3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide
SMILESCCNC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C11H15ClN2O3S/c1-2-13-11(15)7-8-14-18(16,17)10-5-3-9(12)4-6-10/h3-6,14H,2,7-8H2,1H3,(H,13,15)
InChIKeyWDKFQMSLPQBMLA-UHFFFAOYSA-N
MW290.77 g/mol
LogP1.14
Rot. Bonds6

About 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide

3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide (PubChem CID 17225661) has the molecular formula C11H15ClN2O3S and a molecular weight of 290.77 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide.

Molecular Properties

Compound Name3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide
PubChem CID17225661
Molecular FormulaC11H15ClN2O3S
Molecular Weight290.77 g/mol
Exact Mass290.05
IUPAC Name3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide
SMILESCCNC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C11H15ClN2O3S/c1-2-13-11(15)7-8-14-18(16,17)10-5-3-9(12)4-6-10/h3-6,14H,2,7-8H2,1H3,(H,13,15)
InChIKeyWDKFQMSLPQBMLA-UHFFFAOYSA-N
XLogP1.14
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-[(4-chlorophenyl)sulfonylamino]propanoylamino]-N-ethylpropanamide
CID 17411620
3-[(3,4-difluorophenyl)sulfonylamino]-N-ethylpropanamide
CID 47101447
3-[(4-chlorophenyl)sulfonylamino]-N-pentan-3-ylpropanamide
CID 17225690
3-[(4-chlorophenyl)sulfonylamino]-N-[2-(dimethylamino)-2-oxoethyl]propanamide
CID 9480885
3-[(4-chlorophenyl)sulfonylamino]-N-[4-(propylsulfamoyl)phenyl]propanamide
CID 17225792
N-[2-(4-chlorophenoxy)ethyl]-3-[(4-chlorophenyl)sulfonylamino]propanamide
CID 24548368
N-[(4-chlorophenyl)methyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192707
N-[3-(2-but-2-en-2-ylhydrazinyl)-3-oxopropyl]-4-chlorobenzenesulfonamide
CID 4165843
N-[2-(4-chlorophenyl)ethyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 27646822
3-[(4-chlorophenyl)sulfonylamino]-N-(3,5-dimethylphenyl)propanamide
CID 17225585
3-[(4-chlorophenyl)sulfonylamino]-N-(2,6-dimethylphenyl)propanamide
CID 17225634
3-[(4-chlorophenyl)sulfonylamino]-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 8643100

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide?
The IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide (CID 17225661) is 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide.
What is the SMILES notation for 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide?
The canonical SMILES for 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide is CCNC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide?
The InChIKey is WDKFQMSLPQBMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O3S/c1-2-13-11(15)7-8-14-18(16,17)10-5-3-9(12)4-6-10/h3-6,14H,2,7-8H2,1H3,(H,13,15).
What are the key properties of 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide?
3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide has a molecular weight of 290.77 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide is sourced from PubChem (CID 17225661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).