6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid

C18H10Cl2FNO3 — CID 69417477

IUPAC6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
SMILESO=C(O)c1cc(-c2ccc(F)cc2)c(-c2ccc(Cl)cc2Cl)[nH]c1=O
InChIInChI=1S/C18H10Cl2FNO3/c19-10-3-6-12(15(20)7-10)16-13(9-1-4-11(21)5-2-9)8-14(18(24)25)17(23)22-16/h1-8H,(H,22,23)(H,24,25)
InChIKeyRFLGXCWWGOIKOZ-UHFFFAOYSA-N
MW378.19 g/mol
LogP4.85
Rot. Bonds3

About 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid

6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 69417477) has the molecular formula C18H10Cl2FNO3 and a molecular weight of 378.19 g/mol. Its IUPAC name is 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
PubChem CID69417477
Molecular FormulaC18H10Cl2FNO3
Molecular Weight378.19 g/mol
Exact Mass377.00
IUPAC Name6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
SMILESO=C(O)c1cc(-c2ccc(F)cc2)c(-c2ccc(Cl)cc2Cl)[nH]c1=O
InChIInChI=1S/C18H10Cl2FNO3/c19-10-3-6-12(15(20)7-10)16-13(9-1-4-11(21)5-2-9)8-14(18(24)25)17(23)22-16/h1-8H,(H,22,23)(H,24,25)
InChIKeyRFLGXCWWGOIKOZ-UHFFFAOYSA-N
XLogP4.85
TPSA70.16 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.19
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(4-chlorophenyl)-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
CID 71281772
6-(2-Chlorophenyl)-1,2-dihydro-2-oxo-3-pyridinecarboxylic acid
CID 11776853
5-Chloro-1-(2,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid
CID 2764481
6-(3-Chlorophenyl)-1,2-dihydro-2-oxo-3-pyridinecarboxylic acid
CID 10264093
Methyl 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylate
CID 69417262
2-(4-chlorophenyl)-6-oxo-1H-pyridine-3,5-dicarboxylic acid
CID 4674347
6-(3-chloro-4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 61658773
6-(2,4-dichloro-5-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 61658944
6-(2-chloro-4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 64334512
2-(2,4-dichloro-5-fluorophenyl)-6-oxo-1H-pyridine-4-carboxylic acid
CID 91871732
6-(4-Chlorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CID 4715294
6-(4-chlorophenyl)-2-oxo-4-phenyl-1H-pyridine-3-carboxylic acid
CID 12458957

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid (CID 69417477) is 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid is O=C(O)c1cc(-c2ccc(F)cc2)c(-c2ccc(Cl)cc2Cl)[nH]c1=O.
What is the InChIKey of 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is RFLGXCWWGOIKOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10Cl2FNO3/c19-10-3-6-12(15(20)7-10)16-13(9-1-4-11(21)5-2-9)8-14(18(24)25)17(23)22-16/h1-8H,(H,22,23)(H,24,25).
What are the key properties of 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 378.19 g/mol, XLogP of 4.85, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 69417477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).