2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide

C18H22FN3O4S — CID 46770541

IUPAC2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CN(c1ccccc1F)S(=O)(=O)N(C)C
InChIInChI=1S/C18H22FN3O4S/c1-13-9-10-17(26-4)15(11-13)20-18(23)12-22(27(24,25)21(2)3)16-8-6-5-7-14(16)19/h5-11H,12H2,1-4H3,(H,20,23)
InChIKeyBIUFWMAGMPFPNU-UHFFFAOYSA-N
MW395.46 g/mol
LogP2.39
Rot. Bonds7

About 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide

2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 46770541) has the molecular formula C18H22FN3O4S and a molecular weight of 395.46 g/mol. Its IUPAC name is 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID46770541
Molecular FormulaC18H22FN3O4S
Molecular Weight395.46 g/mol
Exact Mass395.13
IUPAC Name2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CN(c1ccccc1F)S(=O)(=O)N(C)C
InChIInChI=1S/C18H22FN3O4S/c1-13-9-10-17(26-4)15(11-13)20-18(23)12-22(27(24,25)21(2)3)16-8-6-5-7-14(16)19/h5-11H,12H2,1-4H3,(H,20,23)
InChIKeyBIUFWMAGMPFPNU-UHFFFAOYSA-N
XLogP2.39
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-(2-fluoro-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 1363111
N-(2-methoxy-5-methylphenyl)-2-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 1333379
N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetamide
CID 53283595
N-(2-fluorophenyl)-2-(2-methoxy-5-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 2280003
N-(5-chloro-2-methoxyphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 2947640
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide
CID 92672912
2-[N-(benzenesulfonyl)-4-chloro-2-methylanilino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 2278594
2-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 126080987
2-(4-fluoro-N-(4-fluorophenyl)sulfonylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 30264956
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 92685178
2-(4-fluoro-N-(4-methylphenyl)sulfonylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 1338618
2-(2-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 2232080

Frequently Asked Questions

What is the IUPAC name of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide (CID 46770541) is 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)CN(c1ccccc1F)S(=O)(=O)N(C)C.
What is the InChIKey of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is BIUFWMAGMPFPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22FN3O4S/c1-13-9-10-17(26-4)15(11-13)20-18(23)12-22(27(24,25)21(2)3)16-8-6-5-7-14(16)19/h5-11H,12H2,1-4H3,(H,20,23).
What are the key properties of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide?
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 395.46 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 46770541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).