2-quinolin-2-ylquinoline-4-carboxylic acid

C19H12N2O2 — CID 919750

IUPAC2-quinolin-2-ylquinoline-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccc3ccccc3n2)nc2ccccc12
InChIInChI=1S/C19H12N2O2/c22-19(23)14-11-18(21-16-8-4-2-6-13(14)16)17-10-9-12-5-1-3-7-15(12)20-17/h1-11H,(H,22,23)
InChIKeyLIPAGYDXXKYYKU-UHFFFAOYSA-N
MW300.32 g/mol
LogP4.15
Rot. Bonds2

About 2-quinolin-2-ylquinoline-4-carboxylic acid

2-quinolin-2-ylquinoline-4-carboxylic acid (PubChem CID 919750) has the molecular formula C19H12N2O2 and a molecular weight of 300.32 g/mol. Its IUPAC name is 2-quinolin-2-ylquinoline-4-carboxylic acid.

Molecular Properties

Compound Name2-quinolin-2-ylquinoline-4-carboxylic acid
PubChem CID919750
Molecular FormulaC19H12N2O2
Molecular Weight300.32 g/mol
Exact Mass300.09
IUPAC Name2-quinolin-2-ylquinoline-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccc3ccccc3n2)nc2ccccc12
InChIInChI=1S/C19H12N2O2/c22-19(23)14-11-18(21-16-8-4-2-6-13(14)16)17-10-9-12-5-1-3-7-15(12)20-17/h1-11H,(H,22,23)
InChIKeyLIPAGYDXXKYYKU-UHFFFAOYSA-N
XLogP4.15
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-quinolin-2-ylquinoline-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-2-ylquinoline-4-carboxylic acid?
The IUPAC name of 2-quinolin-2-ylquinoline-4-carboxylic acid (CID 919750) is 2-quinolin-2-ylquinoline-4-carboxylic acid.
What is the SMILES notation for 2-quinolin-2-ylquinoline-4-carboxylic acid?
The canonical SMILES for 2-quinolin-2-ylquinoline-4-carboxylic acid is O=C(O)c1cc(-c2ccc3ccccc3n2)nc2ccccc12.
What is the InChIKey of 2-quinolin-2-ylquinoline-4-carboxylic acid?
The InChIKey is LIPAGYDXXKYYKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N2O2/c22-19(23)14-11-18(21-16-8-4-2-6-13(14)16)17-10-9-12-5-1-3-7-15(12)20-17/h1-11H,(H,22,23).
What are the key properties of 2-quinolin-2-ylquinoline-4-carboxylic acid?
2-quinolin-2-ylquinoline-4-carboxylic acid has a molecular weight of 300.32 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-2-ylquinoline-4-carboxylic acid is sourced from PubChem (CID 919750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).