5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid

C16H11NO3 — CID 53223531

IUPAC5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid
SMILESO=C(O)c1c[nH]c(=O)c(-c2ccc3ccccc3c2)c1
InChIInChI=1S/C16H11NO3/c18-15-14(8-13(9-17-15)16(19)20)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H,17,18)(H,19,20)
InChIKeyZJPQXWCZBIQIKV-UHFFFAOYSA-N
MW265.27 g/mol
LogP2.89
Rot. Bonds2

About 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid

5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 53223531) has the molecular formula C16H11NO3 and a molecular weight of 265.27 g/mol. Its IUPAC name is 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid
PubChem CID53223531
Molecular FormulaC16H11NO3
Molecular Weight265.27 g/mol
Exact Mass265.07
IUPAC Name5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid
SMILESO=C(O)c1c[nH]c(=O)c(-c2ccc3ccccc3c2)c1
InChIInChI=1S/C16H11NO3/c18-15-14(8-13(9-17-15)16(19)20)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H,17,18)(H,19,20)
InChIKeyZJPQXWCZBIQIKV-UHFFFAOYSA-N
XLogP2.89
TPSA70.16 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid (CID 53223531) is 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid is O=C(O)c1c[nH]c(=O)c(-c2ccc3ccccc3c2)c1.
What is the InChIKey of 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is ZJPQXWCZBIQIKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO3/c18-15-14(8-13(9-17-15)16(19)20)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H,17,18)(H,19,20).
What are the key properties of 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid?
5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 265.27 g/mol, XLogP of 2.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-2-yl-6-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 53223531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).