1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide

C19H16FN3O5S — CID 18560961

IUPAC1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cccn(OCc3ccccc3F)c2=O)cc1
InChIInChI=1S/C19H16FN3O5S/c20-17-6-2-1-4-13(17)12-28-23-11-3-5-16(19(23)25)18(24)22-14-7-9-15(10-8-14)29(21,26)27/h1-11H,12H2,(H,22,24)(H2,21,26,27)
InChIKeyOQMQDSZIWZJLHK-UHFFFAOYSA-N
MW417.42 g/mol
LogP1.52
Rot. Bonds6

About 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide

1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide (PubChem CID 18560961) has the molecular formula C19H16FN3O5S and a molecular weight of 417.42 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
PubChem CID18560961
Molecular FormulaC19H16FN3O5S
Molecular Weight417.42 g/mol
Exact Mass417.08
IUPAC Name1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cccn(OCc3ccccc3F)c2=O)cc1
InChIInChI=1S/C19H16FN3O5S/c20-17-6-2-1-4-13(17)12-28-23-11-3-5-16(19(23)25)18(24)22-14-7-9-15(10-8-14)29(21,26)27/h1-11H,12H2,(H,22,24)(H2,21,26,27)
InChIKeyOQMQDSZIWZJLHK-UHFFFAOYSA-N
XLogP1.52
TPSA120.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.42
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
The IUPAC name of 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide (CID 18560961) is 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide is NS(=O)(=O)c1ccc(NC(=O)c2cccn(OCc3ccccc3F)c2=O)cc1.
What is the InChIKey of 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
The InChIKey is OQMQDSZIWZJLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O5S/c20-17-6-2-1-4-13(17)12-28-23-11-3-5-16(19(23)25)18(24)22-14-7-9-15(10-8-14)29(21,26)27/h1-11H,12H2,(H,22,24)(H2,21,26,27).
What are the key properties of 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide has a molecular weight of 417.42 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methoxy]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 18560961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).