3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid

C22H15NO3 — CID 14498150

IUPAC3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid
SMILESO=C(O)c1c(O)c(-c2ccc(-c3ccccc3)cc2)nc2ccccc12
InChIInChI=1S/C22H15NO3/c24-21-19(22(25)26)17-8-4-5-9-18(17)23-20(21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,24H,(H,25,26)
InChIKeyLXZMXHPFJHRHAD-UHFFFAOYSA-N
MW341.37 g/mol
LogP4.97
Rot. Bonds3

About 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid

3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid (PubChem CID 14498150) has the molecular formula C22H15NO3 and a molecular weight of 341.37 g/mol. Its IUPAC name is 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid
PubChem CID14498150
Molecular FormulaC22H15NO3
Molecular Weight341.37 g/mol
Exact Mass341.11
IUPAC Name3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid
SMILESO=C(O)c1c(O)c(-c2ccc(-c3ccccc3)cc2)nc2ccccc12
InChIInChI=1S/C22H15NO3/c24-21-19(22(25)26)17-8-4-5-9-18(17)23-20(21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,24H,(H,25,26)
InChIKeyLXZMXHPFJHRHAD-UHFFFAOYSA-N
XLogP4.97
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid?
The IUPAC name of 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid (CID 14498150) is 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid.
What is the SMILES notation for 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid?
The canonical SMILES for 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid is O=C(O)c1c(O)c(-c2ccc(-c3ccccc3)cc2)nc2ccccc12.
What is the InChIKey of 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid?
The InChIKey is LXZMXHPFJHRHAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15NO3/c24-21-19(22(25)26)17-8-4-5-9-18(17)23-20(21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,24H,(H,25,26).
What are the key properties of 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid?
3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid has a molecular weight of 341.37 g/mol, XLogP of 4.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid is sourced from PubChem (CID 14498150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).