2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid

C19H15NO4 — CID 102419366

IUPAC2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid
SMILESCOc1ccc(-c2[nH]c(=O)cc(-c3ccccc3)c2C(=O)O)cc1
InChIInChI=1S/C19H15NO4/c1-24-14-9-7-13(8-10-14)18-17(19(22)23)15(11-16(21)20-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,20,21)(H,22,23)
InChIKeyHPKLEGRSQWXFJT-UHFFFAOYSA-N
MW321.33 g/mol
LogP3.42
Rot. Bonds4

About 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid

2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid (PubChem CID 102419366) has the molecular formula C19H15NO4 and a molecular weight of 321.33 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid
PubChem CID102419366
Molecular FormulaC19H15NO4
Molecular Weight321.33 g/mol
Exact Mass321.10
IUPAC Name2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid
SMILESCOc1ccc(-c2[nH]c(=O)cc(-c3ccccc3)c2C(=O)O)cc1
InChIInChI=1S/C19H15NO4/c1-24-14-9-7-13(8-10-14)18-17(19(22)23)15(11-16(21)20-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,20,21)(H,22,23)
InChIKeyHPKLEGRSQWXFJT-UHFFFAOYSA-N
XLogP3.42
TPSA79.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.33
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-methoxyphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxylic acid
CID 82089759
4-(4-methoxyphenyl)-6-oxo-1H-pyridine-2-carboxylic acid
CID 83650239
3-(4-methoxyphenyl)-4-phenyl-1H-pyridazin-6-one
CID 18759983
2-(4-methoxyphenyl)-1-methyl-4-phenylpyrrole-3-carboxylic acid
CID 3730701
5-methyl-4,6-diphenyl-1H-pyridin-2-one
CID 14120548
5-(4-methoxyphenyl)-1H-pyrrole-2-carboxylic acid
CID 15687843
5-(4-methoxyphenyl)-6-phenyl-1H-pyrimidine-2,4-dione
CID 10308352
5-methoxy-2-(4-methoxyphenyl)benzoic acid
CID 2060525
5-ethyl-6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 71281958
[3,5-bis(4-methoxyphenyl)-1H-pyrrol-2-yl]-phenylmethanone
CID 22648579
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
2-(4-methoxyphenyl)-1,4-diphenylbenzene
CID 132547745

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid?
The IUPAC name of 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid (CID 102419366) is 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid is COc1ccc(-c2[nH]c(=O)cc(-c3ccccc3)c2C(=O)O)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid?
The InChIKey is HPKLEGRSQWXFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO4/c1-24-14-9-7-13(8-10-14)18-17(19(22)23)15(11-16(21)20-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,20,21)(H,22,23).
What are the key properties of 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid?
2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid has a molecular weight of 321.33 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 102419366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).