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

C15H14ClFN2O3S — CID 113093031

IUPACN-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
SMILESCC(=O)Nc1ccc(F)cc1NS(=O)(=O)c1ccc(Cl)c(C)c1
InChIInChI=1S/C15H14ClFN2O3S/c1-9-7-12(4-5-13(9)16)23(21,22)19-15-8-11(17)3-6-14(15)18-10(2)20/h3-8,19H,1-2H3,(H,18,20)
InChIKeySNBWYJWIXMBQHS-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.55
Rot. Bonds4

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

N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide (PubChem CID 113093031) has the molecular formula C15H14ClFN2O3S and a molecular weight of 356.81 g/mol. Its IUPAC name is N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
PubChem CID113093031
Molecular FormulaC15H14ClFN2O3S
Molecular Weight356.81 g/mol
Exact Mass356.04
IUPAC NameN-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
SMILESCC(=O)Nc1ccc(F)cc1NS(=O)(=O)c1ccc(Cl)c(C)c1
InChIInChI=1S/C15H14ClFN2O3S/c1-9-7-12(4-5-13(9)16)23(21,22)19-15-8-11(17)3-6-14(15)18-10(2)20/h3-8,19H,1-2H3,(H,18,20)
InChIKeySNBWYJWIXMBQHS-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

N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]phenyl]acetamide
CID 113093718
N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide
CID 113093010
3,4-dichloro-N-(5-fluoro-2-methylphenyl)benzenesulfonamide
CID 8501117
N-[5-[(2-chloro-4-fluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 7514301
3-chloro-N-(4-fluoro-2-methylphenyl)-4-methylbenzenesulfonamide
CID 5003390
N-(2-chloro-5-fluorophenyl)acetamide
CID 102458235
N-[2-[(2,5-dimethylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
CID 113093007
3-[(4-acetamido-3-chlorophenyl)sulfonylamino]-4-methylbenzoic acid
CID 25047152
3,4-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide
CID 26969900
4-chloro-N-(2-chlorophenyl)-3-methylbenzenesulfonamide
CID 839413
N-[2-chloro-4-[(2-chloro-4-fluorophenyl)methylsulfamoyl]phenyl]acetamide
CID 25038184
3,4-dichloro-N-(4-fluoro-2-hydroxyphenyl)benzenesulfonamide
CID 63677626

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide?
The IUPAC name of N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide (CID 113093031) is N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide.
What is the SMILES notation for N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide?
The canonical SMILES for N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide is CC(=O)Nc1ccc(F)cc1NS(=O)(=O)c1ccc(Cl)c(C)c1.
What is the InChIKey of N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide?
The InChIKey is SNBWYJWIXMBQHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O3S/c1-9-7-12(4-5-13(9)16)23(21,22)19-15-8-11(17)3-6-14(15)18-10(2)20/h3-8,19H,1-2H3,(H,18,20).
What are the key properties of N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide?
N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]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-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide is sourced from PubChem (CID 113093031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).