6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid

C15H12FNO3 — CID 151618895

IUPAC6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(C2CC2)n(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C15H12FNO3/c16-10-3-5-11(6-4-10)17-13(9-1-2-9)8-7-12(14(17)18)15(19)20/h3-9H,1-2H2,(H,19,20)
InChIKeyQOBVCHUFYDIVIM-UHFFFAOYSA-N
MW273.26 g/mol
LogP2.55
Rot. Bonds3

About 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid

6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid (PubChem CID 151618895) has the molecular formula C15H12FNO3 and a molecular weight of 273.26 g/mol. Its IUPAC name is 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
PubChem CID151618895
Molecular FormulaC15H12FNO3
Molecular Weight273.26 g/mol
Exact Mass273.08
IUPAC Name6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(C2CC2)n(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C15H12FNO3/c16-10-3-5-11(6-4-10)17-13(9-1-2-9)8-7-12(14(17)18)15(19)20/h3-9H,1-2H2,(H,19,20)
InChIKeyQOBVCHUFYDIVIM-UHFFFAOYSA-N
XLogP2.55
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.26
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
The IUPAC name of 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid (CID 151618895) is 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid.
What is the SMILES notation for 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
The canonical SMILES for 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid is O=C(O)c1ccc(C2CC2)n(-c2ccc(F)cc2)c1=O.
What is the InChIKey of 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
The InChIKey is QOBVCHUFYDIVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO3/c16-10-3-5-11(6-4-10)17-13(9-1-2-9)8-7-12(14(17)18)15(19)20/h3-9H,1-2H2,(H,19,20).
What are the key properties of 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid has a molecular weight of 273.26 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid is sourced from PubChem (CID 151618895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).