5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid

C15H9FN2O3 — CID 139809140

IUPAC5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid
SMILESO=C(O)c1[nH]c(=O)c2ncccc2c1-c1ccc(F)cc1
InChIInChI=1S/C15H9FN2O3/c16-9-5-3-8(4-6-9)11-10-2-1-7-17-12(10)14(19)18-13(11)15(20)21/h1-7H,(H,18,19)(H,20,21)
InChIKeyRAOKUMZIJXFOLM-UHFFFAOYSA-N
MW284.25 g/mol
LogP2.43
Rot. Bonds2

About 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid

5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid (PubChem CID 139809140) has the molecular formula C15H9FN2O3 and a molecular weight of 284.25 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid.

Molecular Properties

Compound Name5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid
PubChem CID139809140
Molecular FormulaC15H9FN2O3
Molecular Weight284.25 g/mol
Exact Mass284.06
IUPAC Name5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid
SMILESO=C(O)c1[nH]c(=O)c2ncccc2c1-c1ccc(F)cc1
InChIInChI=1S/C15H9FN2O3/c16-9-5-3-8(4-6-9)11-10-2-1-7-17-12(10)14(19)18-13(11)15(20)21/h1-7H,(H,18,19)(H,20,21)
InChIKeyRAOKUMZIJXFOLM-UHFFFAOYSA-N
XLogP2.43
TPSA83.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.25
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid?
The IUPAC name of 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid (CID 139809140) is 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid.
What is the SMILES notation for 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid?
The canonical SMILES for 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid is O=C(O)c1[nH]c(=O)c2ncccc2c1-c1ccc(F)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid?
The InChIKey is RAOKUMZIJXFOLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9FN2O3/c16-9-5-3-8(4-6-9)11-10-2-1-7-17-12(10)14(19)18-13(11)15(20)21/h1-7H,(H,18,19)(H,20,21).
What are the key properties of 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid?
5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid has a molecular weight of 284.25 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxylic acid is sourced from PubChem (CID 139809140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).