5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide

C18H14ClFN2O3S — CID 146545919

IUPAC5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide
SMILESCn1cc(Cl)cc(S(=O)(=O)Nc2cc(-c3ccccc3)ccc2F)c1=O
InChIInChI=1S/C18H14ClFN2O3S/c1-22-11-14(19)10-17(18(22)23)26(24,25)21-16-9-13(7-8-15(16)20)12-5-3-2-4-6-12/h2-11,21H,1H3
InChIKeyMGFWJLDVRSUKRN-UHFFFAOYSA-N
MW392.84 g/mol
LogP3.65
Rot. Bonds4

About 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide

5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide (PubChem CID 146545919) has the molecular formula C18H14ClFN2O3S and a molecular weight of 392.84 g/mol. Its IUPAC name is 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide
PubChem CID146545919
Molecular FormulaC18H14ClFN2O3S
Molecular Weight392.84 g/mol
Exact Mass392.04
IUPAC Name5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide
SMILESCn1cc(Cl)cc(S(=O)(=O)Nc2cc(-c3ccccc3)ccc2F)c1=O
InChIInChI=1S/C18H14ClFN2O3S/c1-22-11-14(19)10-17(18(22)23)26(24,25)21-16-9-13(7-8-15(16)20)12-5-3-2-4-6-12/h2-11,21H,1H3
InChIKeyMGFWJLDVRSUKRN-UHFFFAOYSA-N
XLogP3.65
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.84
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide (CID 146545919) is 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide is Cn1cc(Cl)cc(S(=O)(=O)Nc2cc(-c3ccccc3)ccc2F)c1=O.
What is the InChIKey of 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide?
The InChIKey is MGFWJLDVRSUKRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClFN2O3S/c1-22-11-14(19)10-17(18(22)23)26(24,25)21-16-9-13(7-8-15(16)20)12-5-3-2-4-6-12/h2-11,21H,1H3.
What are the key properties of 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide?
5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide has a molecular weight of 392.84 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-fluoro-5-phenylphenyl)-1-methyl-2-oxopyridine-3-sulfonamide is sourced from PubChem (CID 146545919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).