N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide

C15H12Cl2FNO3S — CID 55811044

IUPACN-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide
SMILESCC(C(=O)Nc1cccc(Cl)c1Cl)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C15H12Cl2FNO3S/c1-9(23(21,22)11-7-5-10(18)6-8-11)15(20)19-13-4-2-3-12(16)14(13)17/h2-9H,1H3,(H,19,20)
InChIKeyLGEKXLHEPUKGKO-UHFFFAOYSA-N
MW376.24 g/mol
LogP3.93
Rot. Bonds4

About N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide

N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide (PubChem CID 55811044) has the molecular formula C15H12Cl2FNO3S and a molecular weight of 376.24 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide
PubChem CID55811044
Molecular FormulaC15H12Cl2FNO3S
Molecular Weight376.24 g/mol
Exact Mass374.99
IUPAC NameN-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide
SMILESCC(C(=O)Nc1cccc(Cl)c1Cl)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C15H12Cl2FNO3S/c1-9(23(21,22)11-7-5-10(18)6-8-11)15(20)19-13-4-2-3-12(16)14(13)17/h2-9H,1H3,(H,19,20)
InChIKeyLGEKXLHEPUKGKO-UHFFFAOYSA-N
XLogP3.93
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.24
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(2-chlorophenyl)-2-(3-fluorophenyl)sulfonylpropanamide
CID 129371555
N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
CID 55387332
1-(2,3-dichlorophenyl)-3-[(4-fluorophenyl)sulfonylamino]thiourea
CID 2206508
(2S)-N-[2-(4-chlorophenyl)sulfonylethyl]-2-(4-fluorophenyl)sulfonylpropanamide
CID 95348488
(2R)-2-(4-fluorophenyl)sulfonylpropanoic acid
CID 28753557
(2R)-N-(2,3-dichlorophenyl)-2-phenylpropanamide
CID 97038158
3-amino-N-(2,3-dichlorophenyl)-2-methylpropanamide
CID 62669970
(2S)-2-[[(2S)-2-(4-fluorophenyl)sulfonylpropanoyl]amino]propanamide
CID 94652953
[1-(2,3-dichloroanilino)-1-oxopropan-2-yl] 2-chloro-5-sulfamoylbenzoate
CID 42985996
2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide
CID 75416503
N-(2,3-dichlorophenyl)-2-phenoxypropanamide
CID 2897939
2-[(2,3-dichlorophenyl)carbamoylamino]-3-methylbutanoic acid
CID 3546923

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide (CID 55811044) is N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide is CC(C(=O)Nc1cccc(Cl)c1Cl)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide?
The InChIKey is LGEKXLHEPUKGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2FNO3S/c1-9(23(21,22)11-7-5-10(18)6-8-11)15(20)19-13-4-2-3-12(16)14(13)17/h2-9H,1H3,(H,19,20).
What are the key properties of N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide?
N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide has a molecular weight of 376.24 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(4-fluorophenyl)sulfonylpropanamide is sourced from PubChem (CID 55811044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).