1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide

C20H17FN2O3S — CID 7190069

IUPAC1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide
SMILESCSc1ccccc1NC(=O)c1cccn(OCc2ccccc2F)c1=O
InChIInChI=1S/C20H17FN2O3S/c1-27-18-11-5-4-10-17(18)22-19(24)15-8-6-12-23(20(15)25)26-13-14-7-2-3-9-16(14)21/h2-12H,13H2,1H3,(H,22,24)
InChIKeyJZSPTSVRKIISJM-UHFFFAOYSA-N
MW384.43 g/mol
LogP3.59
Rot. Bonds6

About 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide

1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide (PubChem CID 7190069) has the molecular formula C20H17FN2O3S and a molecular weight of 384.43 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide
PubChem CID7190069
Molecular FormulaC20H17FN2O3S
Molecular Weight384.43 g/mol
Exact Mass384.09
IUPAC Name1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide
SMILESCSc1ccccc1NC(=O)c1cccn(OCc2ccccc2F)c1=O
InChIInChI=1S/C20H17FN2O3S/c1-27-18-11-5-4-10-17(18)22-19(24)15-8-6-12-23(20(15)25)26-13-14-7-2-3-9-16(14)21/h2-12H,13H2,1H3,(H,22,24)
InChIKeyJZSPTSVRKIISJM-UHFFFAOYSA-N
XLogP3.59
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide (CID 7190069) is 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide is CSc1ccccc1NC(=O)c1cccn(OCc2ccccc2F)c1=O.
What is the InChIKey of 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide?
The InChIKey is JZSPTSVRKIISJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3S/c1-27-18-11-5-4-10-17(18)22-19(24)15-8-6-12-23(20(15)25)26-13-14-7-2-3-9-16(14)21/h2-12H,13H2,1H3,(H,22,24).
What are the key properties of 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide?
1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide has a molecular weight of 384.43 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methoxy]-N-(2-methylsulfanylphenyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 7190069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).