2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide

C17H19FN4O5S — CID 7829051

IUPAC2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide
SMILESCN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NCC(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C17H19FN4O5S/c1-21(2)28(26,27)14-7-8-17(25)22(10-14)11-16(24)19-9-15(23)20-13-5-3-12(18)4-6-13/h3-8,10H,9,11H2,1-2H3,(H,19,24)(H,20,23)
InChIKeyYGOCQKFWPWLHSI-UHFFFAOYSA-N
MW410.43 g/mol
LogP-0.01
Rot. Bonds7

About 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide

2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide (PubChem CID 7829051) has the molecular formula C17H19FN4O5S and a molecular weight of 410.43 g/mol. Its IUPAC name is 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide
PubChem CID7829051
Molecular FormulaC17H19FN4O5S
Molecular Weight410.43 g/mol
Exact Mass410.11
IUPAC Name2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide
SMILESCN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NCC(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C17H19FN4O5S/c1-21(2)28(26,27)14-7-8-17(25)22(10-14)11-16(24)19-9-15(23)20-13-5-3-12(18)4-6-13/h3-8,10H,9,11H2,1-2H3,(H,19,24)(H,20,23)
InChIKeyYGOCQKFWPWLHSI-UHFFFAOYSA-N
XLogP-0.01
TPSA117.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.43
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(Cyclohexyl-methanesulfonyl-amino)-N-(2,4-difluoro-phenyl)-acetamide
CID 954246
N~2~-cyclohexyl-N~1~-(2-fluorophenyl)-N~2~-(methylsulfonyl)glycinamide
CID 964121
2-[4-(dimethylsulfamoyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide
CID 973770
2-[cyclohexyl(methylsulfonyl)amino]-N-(4-fluorophenyl)acetamide
CID 2111492
N-cyclohexyl-2-[[2-(4-fluoroanilino)-2-oxoethyl]-methylamino]acetamide
CID 9253429
N-methyl-6-oxo-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]-1H-pyridine-3-carboxamide
CID 17434871
N-(2,4-difluorophenyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide
CID 4824613
N-(tert-Butylcarbamoyl-methyl)-2-[(4-fluoro-phenylcarbamoyl)-methanesulfinyl]-N-phenyl-acetamide
CID 649456
N-Cyclohexyl-N-cyclopentylcarbamoylmethyl-2-[(4-fluoro-phenylcarbamoyl)-methanesulfinyl]-acetamide
CID 650700
N-cycloheptyl-N~2~-(4-fluorophenyl)-N~2~-(phenylsulfonyl)glycinamide
CID 1315019
2-[3-fluoro(methylsulfonyl)anilino]-N-propylacetamide
CID 1729001
2-[3-fluoro(methylsulfonyl)anilino]-N-(1-isopropyl-2-methylpropyl)acetamide
CID 1815770

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide (CID 7829051) is 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide is CN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NCC(=O)Nc2ccc(F)cc2)c1.
What is the InChIKey of 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide?
The InChIKey is YGOCQKFWPWLHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O5S/c1-21(2)28(26,27)14-7-8-17(25)22(10-14)11-16(24)19-9-15(23)20-13-5-3-12(18)4-6-13/h3-8,10H,9,11H2,1-2H3,(H,19,24)(H,20,23).
What are the key properties of 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide?
2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide has a molecular weight of 410.43 g/mol, XLogP of -0.01, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]amino]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 7829051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).