3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide

C15H17ClN2O3S2 — CID 24543595

IUPAC3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide
SMILESCC(NC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)c1cccs1
InChIInChI=1S/C15H17ClN2O3S2/c1-11(14-3-2-10-22-14)18-15(19)8-9-17-23(20,21)13-6-4-12(16)5-7-13/h2-7,10-11,17H,8-9H2,1H3,(H,18,19)
InChIKeyFZEYZZYNQGJRIR-UHFFFAOYSA-N
MW372.90 g/mol
LogP2.95
Rot. Bonds7

About 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide

3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide (PubChem CID 24543595) has the molecular formula C15H17ClN2O3S2 and a molecular weight of 372.90 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide.

Molecular Properties

Compound Name3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide
PubChem CID24543595
Molecular FormulaC15H17ClN2O3S2
Molecular Weight372.90 g/mol
Exact Mass372.04
IUPAC Name3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide
SMILESCC(NC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)c1cccs1
InChIInChI=1S/C15H17ClN2O3S2/c1-11(14-3-2-10-22-14)18-15(19)8-9-17-23(20,21)13-6-4-12(16)5-7-13/h2-7,10-11,17H,8-9H2,1H3,(H,18,19)
InChIKeyFZEYZZYNQGJRIR-UHFFFAOYSA-N
XLogP2.95
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.90
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4-chlorophenyl)sulfonylamino]-N-(1-pyridin-4-ylethyl)propanamide
CID 24639242
3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide
CID 9482091
3-[(4-chlorophenyl)sulfonylamino]-N-pentan-3-ylpropanamide
CID 17225690
3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(3,4-difluorophenyl)ethyl]propanamide
CID 25493668
3-(methylamino)-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 81408507
3-[(3,4-difluorophenyl)sulfonylamino]-N-(3-methyl-1-thiophen-2-ylbutyl)propanamide
CID 55976936
2-[3-[(4-chlorophenyl)sulfonylamino]propanoylamino]-N-ethylpropanamide
CID 17411620
N-[1-(2-chlorophenyl)ethyl]-3-[(4-propan-2-ylphenyl)sulfonylamino]propanamide
CID 24543985
2-(4-chlorophenyl)sulfanyl-N-[(1R)-1-thiophen-2-ylethyl]acetamide
CID 7501191
3-[(3-chlorophenyl)sulfonylamino]-N-propan-2-ylpropanamide
CID 27648389
3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide
CID 17225661
4-oxo-4-(1-thiophen-2-ylethylamino)butanoic acid
CID 43399724

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide?
The IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide (CID 24543595) is 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide.
What is the SMILES notation for 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide?
The canonical SMILES for 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide is CC(NC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)c1cccs1.
What is the InChIKey of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide?
The InChIKey is FZEYZZYNQGJRIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O3S2/c1-11(14-3-2-10-22-14)18-15(19)8-9-17-23(20,21)13-6-4-12(16)5-7-13/h2-7,10-11,17H,8-9H2,1H3,(H,18,19).
What are the key properties of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide?
3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide has a molecular weight of 372.90 g/mol, XLogP of 2.95, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide is sourced from PubChem (CID 24543595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).