2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide

C16H17FN4O5S — CID 7828884

IUPAC2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NC(=O)Nc2ccccc2F)c1
InChIInChI=1S/C16H17FN4O5S/c1-20(2)27(25,26)11-7-8-15(23)21(9-11)10-14(22)19-16(24)18-13-6-4-3-5-12(13)17/h3-9H,10H2,1-2H3,(H2,18,19,22,24)
InChIKeyJNOYOYMDUZQLSI-UHFFFAOYSA-N
MW396.40 g/mol
LogP0.59
Rot. Bonds5

About 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide

2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide (PubChem CID 7828884) has the molecular formula C16H17FN4O5S and a molecular weight of 396.40 g/mol. Its IUPAC name is 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide.

Molecular Properties

Compound Name2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide
PubChem CID7828884
Molecular FormulaC16H17FN4O5S
Molecular Weight396.40 g/mol
Exact Mass396.09
IUPAC Name2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NC(=O)Nc2ccccc2F)c1
InChIInChI=1S/C16H17FN4O5S/c1-20(2)27(25,26)11-7-8-15(23)21(9-11)10-14(22)19-16(24)18-13-6-4-3-5-12(13)17/h3-9H,10H2,1-2H3,(H2,18,19,22,24)
InChIKeyJNOYOYMDUZQLSI-UHFFFAOYSA-N
XLogP0.59
TPSA117.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.40
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide?
The IUPAC name of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide (CID 7828884) is 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide.
What is the SMILES notation for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide?
The canonical SMILES for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide is CN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NC(=O)Nc2ccccc2F)c1.
What is the InChIKey of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide?
The InChIKey is JNOYOYMDUZQLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN4O5S/c1-20(2)27(25,26)11-7-8-15(23)21(9-11)10-14(22)19-16(24)18-13-6-4-3-5-12(13)17/h3-9H,10H2,1-2H3,(H2,18,19,22,24).
What are the key properties of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide?
2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide has a molecular weight of 396.40 g/mol, XLogP of 0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2-fluorophenyl)carbamoyl]acetamide is sourced from PubChem (CID 7828884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).