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

C17H19FN2O3S — CID 45372341

IUPAC2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1cccc(C)c1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C17H19FN2O3S/c1-3-20(24(22,23)16-9-7-14(18)8-10-16)12-17(21)19-15-6-4-5-13(2)11-15/h4-11H,3,12H2,1-2H3,(H,19,21)
InChIKeyKTUYBCBAATWWPM-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.78
Rot. Bonds6

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

2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide (PubChem CID 45372341) has the molecular formula C17H19FN2O3S and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
PubChem CID45372341
Molecular FormulaC17H19FN2O3S
Molecular Weight350.42 g/mol
Exact Mass350.11
IUPAC Name2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1cccc(C)c1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C17H19FN2O3S/c1-3-20(24(22,23)16-9-7-14(18)8-10-16)12-17(21)19-15-6-4-5-13(2)11-15/h4-11H,3,12H2,1-2H3,(H,19,21)
InChIKeyKTUYBCBAATWWPM-UHFFFAOYSA-N
XLogP2.78
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-fluorophenyl)acetamide
CID 45372456
N-(4-acetamidophenyl)-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
CID 2546752
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 100797241
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)acetamide
CID 45372361
N-(2,6-diethylphenyl)-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
CID 2988526
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-[3-(4-methyl-6-oxo-1H-pyrimidin-2-yl)phenyl]acetamide
CID 136818244
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
CID 3163586
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 28547972
2-[[4-(diethylsulfamoyl)phenyl]sulfonyl-[(4-fluorophenyl)methyl]amino]-N-phenylacetamide
CID 1435666
4-(diethylsulfamoyl)-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 9341770
2-[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 29357217
methyl 4-[[2-[ethyl-(4-fluorophenyl)sulfonylamino]acetyl]amino]benzoate
CID 2986721

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide (CID 45372341) is 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide is CCN(CC(=O)Nc1cccc(C)c1)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
The InChIKey is KTUYBCBAATWWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3S/c1-3-20(24(22,23)16-9-7-14(18)8-10-16)12-17(21)19-15-6-4-5-13(2)11-15/h4-11H,3,12H2,1-2H3,(H,19,21).
What are the key properties of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide has a molecular weight of 350.42 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 45372341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).