4-hydroxy-8-oxoquinolizine-3-carboxylic acid

C10H7NO4 — CID 136982100

IUPAC4-hydroxy-8-oxoquinolizine-3-carboxylic acid
SMILESO=C(O)c1ccc2cc(=O)ccn2c1O
InChIInChI=1S/C10H7NO4/c12-7-3-4-11-6(5-7)1-2-8(9(11)13)10(14)15/h1-5,13H,(H,14,15)
InChIKeyLDHIOBDCZIJPSG-UHFFFAOYSA-N
MW205.17 g/mol
LogP0.70
Rot. Bonds1

About 4-hydroxy-8-oxoquinolizine-3-carboxylic acid

4-hydroxy-8-oxoquinolizine-3-carboxylic acid (PubChem CID 136982100) has the molecular formula C10H7NO4 and a molecular weight of 205.17 g/mol. Its IUPAC name is 4-hydroxy-8-oxoquinolizine-3-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-8-oxoquinolizine-3-carboxylic acid
PubChem CID136982100
Molecular FormulaC10H7NO4
Molecular Weight205.17 g/mol
Exact Mass205.04
IUPAC Name4-hydroxy-8-oxoquinolizine-3-carboxylic acid
SMILESO=C(O)c1ccc2cc(=O)ccn2c1O
InChIInChI=1S/C10H7NO4/c12-7-3-4-11-6(5-7)1-2-8(9(11)13)10(14)15/h1-5,13H,(H,14,15)
InChIKeyLDHIOBDCZIJPSG-UHFFFAOYSA-N
XLogP0.70
TPSA79.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.17
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

8-bromo-4-oxoquinolizine-3-carboxylic acid
CID 115049814
7-oxo-1H-imidazo[1,2-a]pyridine-3-carboxylic acid
CID 67976217
7-hydroxyindolizine-3-carboxylic acid
CID 115014793
7-aminoindolizine-3-carboxylic acid
CID 155920997
benzene-1,2,4,5-tetracarboxylic acid;lanthanum
CID 157172767
2,5-dicarboxybenzene-1,4-dithiolate
CID 137252248
9-methoxy-4-oxoquinolizine-3-carboxylic acid
CID 56617934
benzene-1,2,4,5-tetracarboxylic acid;ethene
CID 69404870
potassium;benzene-1,2,4,5-tetracarboxylic acid;hydride
CID 174674645
4-amino-2-hydroxybenzoic acid;dihydrochloride
CID 140557780
2-chloro-3-hydroxy-4-iodobenzoic acid
CID 130296640
sodium;2,3-dihydroxyterephthalic acid;hydride
CID 175464540

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-8-oxoquinolizine-3-carboxylic acid?
The IUPAC name of 4-hydroxy-8-oxoquinolizine-3-carboxylic acid (CID 136982100) is 4-hydroxy-8-oxoquinolizine-3-carboxylic acid.
What is the SMILES notation for 4-hydroxy-8-oxoquinolizine-3-carboxylic acid?
The canonical SMILES for 4-hydroxy-8-oxoquinolizine-3-carboxylic acid is O=C(O)c1ccc2cc(=O)ccn2c1O.
What is the InChIKey of 4-hydroxy-8-oxoquinolizine-3-carboxylic acid?
The InChIKey is LDHIOBDCZIJPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO4/c12-7-3-4-11-6(5-7)1-2-8(9(11)13)10(14)15/h1-5,13H,(H,14,15).
What are the key properties of 4-hydroxy-8-oxoquinolizine-3-carboxylic acid?
4-hydroxy-8-oxoquinolizine-3-carboxylic acid has a molecular weight of 205.17 g/mol, XLogP of 0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-8-oxoquinolizine-3-carboxylic acid is sourced from PubChem (CID 136982100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).