2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide

C19H24FN3O3S — CID 92672912

IUPAC2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CN(c1ccccc1F)S(=O)(=O)N(C)C
InChIInChI=1S/C19H24FN3O3S/c1-14(2)15-9-5-7-11-17(15)21-19(24)13-23(27(25,26)22(3)4)18-12-8-6-10-16(18)20/h5-12,14H,13H2,1-4H3,(H,21,24)
InChIKeyWNSDBZPMLCUOCQ-UHFFFAOYSA-N
MW393.48 g/mol
LogP3.20
Rot. Bonds7

About 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide

2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 92672912) has the molecular formula C19H24FN3O3S and a molecular weight of 393.48 g/mol. Its IUPAC name is 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide
PubChem CID92672912
Molecular FormulaC19H24FN3O3S
Molecular Weight393.48 g/mol
Exact Mass393.15
IUPAC Name2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CN(c1ccccc1F)S(=O)(=O)N(C)C
InChIInChI=1S/C19H24FN3O3S/c1-14(2)15-9-5-7-11-17(15)21-19(24)13-23(27(25,26)22(3)4)18-12-8-6-10-16(18)20/h5-12,14H,13H2,1-4H3,(H,21,24)
InChIKeyWNSDBZPMLCUOCQ-UHFFFAOYSA-N
XLogP3.20
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.48
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methyl-N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 1317403
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 46770541
N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetamide
CID 53283595
2-[N-(benzenesulfonyl)-2-methylanilino]-N-(2-propan-2-ylphenyl)acetamide
CID 2111548
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 46771829
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-propylacetamide
CID 30391962
2-(N-methylsulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 113153663
N-[4-(diethylaminomethyl)phenyl]-2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetamide
CID 43909013
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 53283554
N-(1,3-benzodioxol-5-yl)-2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetamide
CID 43909035
2-[N-(benzenesulfonyl)-2-fluoroanilino]-N-(2-ethylphenyl)acetamide
CID 1095217
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 92685375

Frequently Asked Questions

What is the IUPAC name of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide (CID 92672912) is 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)CN(c1ccccc1F)S(=O)(=O)N(C)C.
What is the InChIKey of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is WNSDBZPMLCUOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O3S/c1-14(2)15-9-5-7-11-17(15)21-19(24)13-23(27(25,26)22(3)4)18-12-8-6-10-16(18)20/h5-12,14H,13H2,1-4H3,(H,21,24).
What are the key properties of 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide?
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 393.48 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 92672912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).