8-hydroxy-6-methoxyquinoline-4-carboxylic acid

C11H9NO4 — CID 174995334

IUPAC8-hydroxy-6-methoxyquinoline-4-carboxylic acid
SMILESCOc1cc(O)c2nccc(C(=O)O)c2c1
InChIInChI=1S/C11H9NO4/c1-16-6-4-8-7(11(14)15)2-3-12-10(8)9(13)5-6/h2-5,13H,1H3,(H,14,15)
InChIKeyXRVUXVSJVDWCNZ-UHFFFAOYSA-N
MW219.20 g/mol
LogP1.65
Rot. Bonds2

About 8-hydroxy-6-methoxyquinoline-4-carboxylic acid

8-hydroxy-6-methoxyquinoline-4-carboxylic acid (PubChem CID 174995334) has the molecular formula C11H9NO4 and a molecular weight of 219.20 g/mol. Its IUPAC name is 8-hydroxy-6-methoxyquinoline-4-carboxylic acid.

Molecular Properties

Compound Name8-hydroxy-6-methoxyquinoline-4-carboxylic acid
PubChem CID174995334
Molecular FormulaC11H9NO4
Molecular Weight219.20 g/mol
Exact Mass219.05
IUPAC Name8-hydroxy-6-methoxyquinoline-4-carboxylic acid
SMILESCOc1cc(O)c2nccc(C(=O)O)c2c1
InChIInChI=1S/C11H9NO4/c1-16-6-4-8-7(11(14)15)2-3-12-10(8)9(13)5-6/h2-5,13H,1H3,(H,14,15)
InChIKeyXRVUXVSJVDWCNZ-UHFFFAOYSA-N
XLogP1.65
TPSA79.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-6-methoxyquinoline-4-carboxylic acid?
The IUPAC name of 8-hydroxy-6-methoxyquinoline-4-carboxylic acid (CID 174995334) is 8-hydroxy-6-methoxyquinoline-4-carboxylic acid.
What is the SMILES notation for 8-hydroxy-6-methoxyquinoline-4-carboxylic acid?
The canonical SMILES for 8-hydroxy-6-methoxyquinoline-4-carboxylic acid is COc1cc(O)c2nccc(C(=O)O)c2c1.
What is the InChIKey of 8-hydroxy-6-methoxyquinoline-4-carboxylic acid?
The InChIKey is XRVUXVSJVDWCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO4/c1-16-6-4-8-7(11(14)15)2-3-12-10(8)9(13)5-6/h2-5,13H,1H3,(H,14,15).
What are the key properties of 8-hydroxy-6-methoxyquinoline-4-carboxylic acid?
8-hydroxy-6-methoxyquinoline-4-carboxylic acid has a molecular weight of 219.20 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-6-methoxyquinoline-4-carboxylic acid is sourced from PubChem (CID 174995334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).