quinoline-2-carboxylic acid

C10H7NO2 — CID 7124

IUPACquinoline-2-carboxylic acid
SMILESO=C(O)c1ccc2ccccc2n1
InChIInChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)
InChIKeyLOAUVZALPPNFOQ-UHFFFAOYSA-N
MW173.17 g/mol
LogP1.93
Rot. Bonds1

About quinoline-2-carboxylic acid

quinoline-2-carboxylic acid (PubChem CID 7124) has the molecular formula C10H7NO2 and a molecular weight of 173.17 g/mol. Its IUPAC name is quinoline-2-carboxylic acid.

Molecular Properties

Compound Namequinoline-2-carboxylic acid
PubChem CID7124
Molecular FormulaC10H7NO2
Molecular Weight173.17 g/mol
Exact Mass173.05
IUPAC Namequinoline-2-carboxylic acid
SMILESO=C(O)c1ccc2ccccc2n1
InChIInChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)
InChIKeyLOAUVZALPPNFOQ-UHFFFAOYSA-N
XLogP1.93
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of quinoline-2-carboxylic acid?
The IUPAC name of quinoline-2-carboxylic acid (CID 7124) is quinoline-2-carboxylic acid.
What is the SMILES notation for quinoline-2-carboxylic acid?
The canonical SMILES for quinoline-2-carboxylic acid is O=C(O)c1ccc2ccccc2n1.
What is the InChIKey of quinoline-2-carboxylic acid?
The InChIKey is LOAUVZALPPNFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13).
What are the key properties of quinoline-2-carboxylic acid?
quinoline-2-carboxylic acid has a molecular weight of 173.17 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for quinoline-2-carboxylic acid is sourced from PubChem (CID 7124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).