4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid

C15H12N2O4 — CID 43325986

IUPAC4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid
SMILESO=C1CCc2cc(Oc3ccnc(C(=O)O)c3)ccc2N1
InChIInChI=1S/C15H12N2O4/c18-14-4-1-9-7-10(2-3-12(9)17-14)21-11-5-6-16-13(8-11)15(19)20/h2-3,5-8H,1,4H2,(H,17,18)(H,19,20)
InChIKeyOJQXNVYXRKDPOE-UHFFFAOYSA-N
MW284.27 g/mol
LogP2.46
Rot. Bonds3

About 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid

4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid (PubChem CID 43325986) has the molecular formula C15H12N2O4 and a molecular weight of 284.27 g/mol. Its IUPAC name is 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid
PubChem CID43325986
Molecular FormulaC15H12N2O4
Molecular Weight284.27 g/mol
Exact Mass284.08
IUPAC Name4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid
SMILESO=C1CCc2cc(Oc3ccnc(C(=O)O)c3)ccc2N1
InChIInChI=1S/C15H12N2O4/c18-14-4-1-9-7-10(2-3-12(9)17-14)21-11-5-6-16-13(8-11)15(19)20/h2-3,5-8H,1,4H2,(H,17,18)(H,19,20)
InChIKeyOJQXNVYXRKDPOE-UHFFFAOYSA-N
XLogP2.46
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid?
The IUPAC name of 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid (CID 43325986) is 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid.
What is the SMILES notation for 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid?
The canonical SMILES for 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid is O=C1CCc2cc(Oc3ccnc(C(=O)O)c3)ccc2N1.
What is the InChIKey of 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid?
The InChIKey is OJQXNVYXRKDPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O4/c18-14-4-1-9-7-10(2-3-12(9)17-14)21-11-5-6-16-13(8-11)15(19)20/h2-3,5-8H,1,4H2,(H,17,18)(H,19,20).
What are the key properties of 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid?
4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid has a molecular weight of 284.27 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid is sourced from PubChem (CID 43325986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).