2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide

C15H12ClF2NO4S — CID 8503445

IUPAC2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1
InChIInChI=1S/C15H12ClF2NO4S/c16-10-1-5-12(6-2-10)23-9-14(20)19-11-3-7-13(8-4-11)24(21,22)15(17)18/h1-8,15H,9H2,(H,19,20)
InChIKeyRHTYYKQHGOHELI-UHFFFAOYSA-N
MW375.78 g/mol
LogP3.35
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide

2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide (PubChem CID 8503445) has the molecular formula C15H12ClF2NO4S and a molecular weight of 375.78 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
PubChem CID8503445
Molecular FormulaC15H12ClF2NO4S
Molecular Weight375.78 g/mol
Exact Mass375.01
IUPAC Name2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1
InChIInChI=1S/C15H12ClF2NO4S/c16-10-1-5-12(6-2-10)23-9-14(20)19-11-3-7-13(8-4-11)24(21,22)15(17)18/h1-8,15H,9H2,(H,19,20)
InChIKeyRHTYYKQHGOHELI-UHFFFAOYSA-N
XLogP3.35
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.78
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2710578
N-(4-chlorophenyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide
CID 5185109
[2-(4-ethoxyanilino)-2-oxoethyl] 4-(difluoromethylsulfonyl)benzoate
CID 7680166
2-[2-[4-(difluoromethylsulfonyl)anilino]-2-oxoethoxy]acetic acid
CID 60708142
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-2,2,2-trifluoroacetamide
CID 112505285
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenoxy)acetamide
CID 1010577
methyl 3-[2-[4-(difluoromethylsulfonyl)anilino]-2-oxoethoxy]benzoate
CID 55468453
2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
CID 26898105
N-(4-chlorophenyl)-2-[4-[(3,5-dimethylphenyl)sulfamoyl]phenoxy]acetamide
CID 3918848
N-(4-chlorophenyl)-2-[4-(cyclohexylsulfamoyl)phenoxy]acetamide
CID 45374352
[4-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]sulfonyl-(1,3-thiazol-2-yl)azanide
CID 4747512
2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide
CID 112980930

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide (CID 8503445) is 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide is O=C(COc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
The InChIKey is RHTYYKQHGOHELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClF2NO4S/c16-10-1-5-12(6-2-10)23-9-14(20)19-11-3-7-13(8-4-11)24(21,22)15(17)18/h1-8,15H,9H2,(H,19,20).
What are the key properties of 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide has a molecular weight of 375.78 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide is sourced from PubChem (CID 8503445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).