2-(furan-2-yl)quinoline-4-carboxylic acid

C14H9NO3 — CID 697640

IUPAC2-(furan-2-yl)quinoline-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C14H9NO3/c16-14(17)10-8-12(13-6-3-7-18-13)15-11-5-2-1-4-9(10)11/h1-8H,(H,16,17)
InChIKeyWWEKTFINADFAEC-UHFFFAOYSA-N
MW239.23 g/mol
LogP3.19
Rot. Bonds2

About 2-(furan-2-yl)quinoline-4-carboxylic acid

2-(furan-2-yl)quinoline-4-carboxylic acid (PubChem CID 697640) has the molecular formula C14H9NO3 and a molecular weight of 239.23 g/mol. Its IUPAC name is 2-(furan-2-yl)quinoline-4-carboxylic acid.

Molecular Properties

Compound Name2-(furan-2-yl)quinoline-4-carboxylic acid
PubChem CID697640
Molecular FormulaC14H9NO3
Molecular Weight239.23 g/mol
Exact Mass239.06
IUPAC Name2-(furan-2-yl)quinoline-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C14H9NO3/c16-14(17)10-8-12(13-6-3-7-18-13)15-11-5-2-1-4-9(10)11/h1-8H,(H,16,17)
InChIKeyWWEKTFINADFAEC-UHFFFAOYSA-N
XLogP3.19
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)quinoline-4-carboxylic acid?
The IUPAC name of 2-(furan-2-yl)quinoline-4-carboxylic acid (CID 697640) is 2-(furan-2-yl)quinoline-4-carboxylic acid.
What is the SMILES notation for 2-(furan-2-yl)quinoline-4-carboxylic acid?
The canonical SMILES for 2-(furan-2-yl)quinoline-4-carboxylic acid is O=C(O)c1cc(-c2ccco2)nc2ccccc12.
What is the InChIKey of 2-(furan-2-yl)quinoline-4-carboxylic acid?
The InChIKey is WWEKTFINADFAEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9NO3/c16-14(17)10-8-12(13-6-3-7-18-13)15-11-5-2-1-4-9(10)11/h1-8H,(H,16,17).
What are the key properties of 2-(furan-2-yl)quinoline-4-carboxylic acid?
2-(furan-2-yl)quinoline-4-carboxylic acid has a molecular weight of 239.23 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)quinoline-4-carboxylic acid is sourced from PubChem (CID 697640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).