N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide

C15H14ClFN2O3S — CID 47062928

IUPACN-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1
InChIInChI=1S/C15H14ClFN2O3S/c1-9-3-5-12(18-10(2)20)8-14(9)19-23(21,22)15-6-4-11(16)7-13(15)17/h3-8,19H,1-2H3,(H,18,20)
InChIKeyILFNYLRFFVJXHO-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.55
Rot. Bonds4

About N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide

N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide (PubChem CID 47062928) has the molecular formula C15H14ClFN2O3S and a molecular weight of 356.81 g/mol. Its IUPAC name is N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide
PubChem CID47062928
Molecular FormulaC15H14ClFN2O3S
Molecular Weight356.81 g/mol
Exact Mass356.04
IUPAC NameN-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1
InChIInChI=1S/C15H14ClFN2O3S/c1-9-3-5-12(18-10(2)20)8-14(9)19-23(21,22)15-6-4-11(16)7-13(15)17/h3-8,19H,1-2H3,(H,18,20)
InChIKeyILFNYLRFFVJXHO-UHFFFAOYSA-N
XLogP3.55
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2-fluoro-N-[5-(hydroxymethyl)-2-methylphenyl]benzenesulfonamide
CID 111444702
N-[4-[[4-[(5-chloro-2-methylphenyl)sulfamoyl]phenyl]sulfamoyl]phenyl]acetamide
CID 1319892
N-(3-amino-2,4-dimethylphenyl)-4-chloro-2-fluorobenzenesulfonamide
CID 60973193
2,5-dichloro-N-[3-[(2,5-dichlorophenyl)sulfonylamino]-4-methylphenyl]benzenesulfonamide
CID 4199762
N-[4-fluoro-3-[(2-methyl-5-nitrophenyl)sulfonylamino]phenyl]acetamide
CID 55560089
N-[5-[(2,4-difluorophenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 134017686
4-chloro-N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide
CID 47308842
N-[4-fluoro-3-[(4-methylphenyl)sulfonylamino]phenyl]acetamide
CID 134040597
4-chloro-2-fluoro-N-(4-iodo-2-methylphenyl)benzenesulfonamide
CID 47104375
N-tert-butyl-4-[(4-chloro-2-fluorophenyl)sulfonylamino]benzamide
CID 24663149
N-[5-[(2,5-dimethylphenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 24656726
N-[3-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]-4-fluorophenyl]acetamide
CID 55895951

Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide?
The IUPAC name of N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide (CID 47062928) is N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide.
What is the SMILES notation for N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide?
The canonical SMILES for N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide is CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(Cl)cc2F)c1.
What is the InChIKey of N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide?
The InChIKey is ILFNYLRFFVJXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O3S/c1-9-3-5-12(18-10(2)20)8-14(9)19-23(21,22)15-6-4-11(16)7-13(15)17/h3-8,19H,1-2H3,(H,18,20).
What are the key properties of N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide?
N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide has a molecular weight of 356.81 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-chloro-2-fluorophenyl)sulfonylamino]-4-methylphenyl]acetamide is sourced from PubChem (CID 47062928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).