5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid

C19H12N2O3 — CID 57396761

IUPAC5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid
SMILESO=C(O)c1ccc2c(c1)nc(-c1cccc(O)c1)c1ccncc12
InChIInChI=1S/C19H12N2O3/c22-13-3-1-2-11(8-13)18-15-6-7-20-10-16(15)14-5-4-12(19(23)24)9-17(14)21-18/h1-10,22H,(H,23,24)
InChIKeyRBQHWKKGMVDAKR-UHFFFAOYSA-N
MW316.32 g/mol
LogP3.85
Rot. Bonds2

About 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid

5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid (PubChem CID 57396761) has the molecular formula C19H12N2O3 and a molecular weight of 316.32 g/mol. Its IUPAC name is 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid.

Molecular Properties

Compound Name5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid
PubChem CID57396761
Molecular FormulaC19H12N2O3
Molecular Weight316.32 g/mol
Exact Mass316.08
IUPAC Name5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid
SMILESO=C(O)c1ccc2c(c1)nc(-c1cccc(O)c1)c1ccncc12
InChIInChI=1S/C19H12N2O3/c22-13-3-1-2-11(8-13)18-15-6-7-20-10-16(15)14-5-4-12(19(23)24)9-17(14)21-18/h1-10,22H,(H,23,24)
InChIKeyRBQHWKKGMVDAKR-UHFFFAOYSA-N
XLogP3.85
TPSA83.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.32
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-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

Related Compounds

8-Hydroxy-5-quinolinecarboxylic acid
CID 459617
8-Quinolinol, benzoate (1:1)
CID 62626
4-Quinolinecarboxylic acid
CID 10243
8-Hydroxyquinoline-7-carboxylic Acid
CID 231363
5-(4-Chlorophenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid
CID 25253151
Cinchoninic acid, 2-(3-pyridyl)-
CID 24067
2-(Pyridin-2-yl)quinoline-4-carboxylic acid
CID 24103
2-(Pyridin-4-yl)quinoline-4-carboxylic acid
CID 26587
Anthranilic acid, N-(alpha-(8-hydroxy-7-quinolyl)benzyl)-
CID 95307
(3-Benzylphenyl)(8-hydroxyquinolin-7-yl)methanone
CID 463001
8-Methyl-2-pyridin-3-ylquinoline-4-carboxylic acid
CID 3768281
Cinchoninic acid, 6-methyl-2-(3-pyridyl)-
CID 21187

Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid?
The IUPAC name of 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid (CID 57396761) is 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid.
What is the SMILES notation for 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid?
The canonical SMILES for 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid is O=C(O)c1ccc2c(c1)nc(-c1cccc(O)c1)c1ccncc12.
What is the InChIKey of 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid?
The InChIKey is RBQHWKKGMVDAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N2O3/c22-13-3-1-2-11(8-13)18-15-6-7-20-10-16(15)14-5-4-12(19(23)24)9-17(14)21-18/h1-10,22H,(H,23,24).
What are the key properties of 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid?
5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid has a molecular weight of 316.32 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxyphenyl)benzo[c][2,6]naphthyridine-8-carboxylic acid is sourced from PubChem (CID 57396761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).