2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide

C15H12Cl3FN2O3S — CID 55559782

IUPAC2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
SMILESCN(CC(=O)Nc1c(Cl)cccc1Cl)S(=O)(=O)c1ccc(F)cc1Cl
InChIInChI=1S/C15H12Cl3FN2O3S/c1-21(25(23,24)13-6-5-9(19)7-12(13)18)8-14(22)20-15-10(16)3-2-4-11(15)17/h2-7H,8H2,1H3,(H,20,22)
InChIKeyHAVZLOBQBNDRLA-UHFFFAOYSA-N
MW425.70 g/mol
LogP4.05
Rot. Bonds5

About 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide

2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide (PubChem CID 55559782) has the molecular formula C15H12Cl3FN2O3S and a molecular weight of 425.70 g/mol. Its IUPAC name is 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
PubChem CID55559782
Molecular FormulaC15H12Cl3FN2O3S
Molecular Weight425.70 g/mol
Exact Mass423.96
IUPAC Name2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
SMILESCN(CC(=O)Nc1c(Cl)cccc1Cl)S(=O)(=O)c1ccc(F)cc1Cl
InChIInChI=1S/C15H12Cl3FN2O3S/c1-21(25(23,24)13-6-5-9(19)7-12(13)18)8-14(22)20-15-10(16)3-2-4-11(15)17/h2-7H,8H2,1H3,(H,20,22)
InChIKeyHAVZLOBQBNDRLA-UHFFFAOYSA-N
XLogP4.05
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.70
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-chloro-2-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 39632702
2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 34055922
2-chloro-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-fluorobenzamide
CID 34169732
N-(2,6-dichlorophenyl)-2-(dimethylamino)acetamide
CID 9255062
2-(2-chloro-4-fluoroanilino)-N-(2,6-dichlorophenyl)acetamide
CID 43404197
(E)-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-3-(3-fluorophenyl)-N-methylprop-2-enamide
CID 40605985
2-[(3,5-dichlorophenyl)sulfonyl-methylamino]-N-(3-fluorophenyl)acetamide
CID 26942310
2-[(2-chlorophenyl)sulfonyl-methylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 7937851
2-[2-(2-chloro-4-fluorophenyl)propan-2-ylamino]-N-(2,6-dichlorophenyl)acetamide
CID 86949913
2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-(2,6-dichlorophenyl)acetamide
CID 126010528
N-(4-bromo-2-methylphenyl)-2-[(2-chloro-4-methylphenyl)sulfonyl-methylamino]acetamide
CID 32676028
2-[(2-chloro-4-fluorophenyl)sulfonyl-propan-2-ylamino]acetic acid
CID 60827819

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
The IUPAC name of 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide (CID 55559782) is 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide is CN(CC(=O)Nc1c(Cl)cccc1Cl)S(=O)(=O)c1ccc(F)cc1Cl.
What is the InChIKey of 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
The InChIKey is HAVZLOBQBNDRLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl3FN2O3S/c1-21(25(23,24)13-6-5-9(19)7-12(13)18)8-14(22)20-15-10(16)3-2-4-11(15)17/h2-7H,8H2,1H3,(H,20,22).
What are the key properties of 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide has a molecular weight of 425.70 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chloro-4-fluorophenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 55559782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).