3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid

C17H13NO2 — CID 107525274

IUPAC3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid
SMILESCc1ccc(-c2cccnc2C(=O)O)c2ccccc12
InChIInChI=1S/C17H13NO2/c1-11-8-9-14(13-6-3-2-5-12(11)13)15-7-4-10-18-16(15)17(19)20/h2-10H,1H3,(H,19,20)
InChIKeyAWGZQMIOLWBLIE-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.91
Rot. Bonds2

About 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid

3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid (PubChem CID 107525274) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid
PubChem CID107525274
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC Name3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid
SMILESCc1ccc(-c2cccnc2C(=O)O)c2ccccc12
InChIInChI=1S/C17H13NO2/c1-11-8-9-14(13-6-3-2-5-12(11)13)15-7-4-10-18-16(15)17(19)20/h2-10H,1H3,(H,19,20)
InChIKeyAWGZQMIOLWBLIE-UHFFFAOYSA-N
XLogP3.91
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-methylnaphthalen-1-yl)pyridine-2-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

3-(2-methoxy-3,4-dimethylphenyl)pyridine-2-carboxylic acid
CID 107525186
3-phenylpyridine-2-carboxylic acid
CID 2762789
3-[2-(hydroxymethyl)phenyl]pyridine-2-carboxylic acid
CID 53222725
2-methyl-3-(4-methylnaphthalen-1-yl)benzoic acid
CID 53405299
3-(4-methoxy-2,5-dimethylphenyl)pyridine-2-carboxylic acid
CID 107525139
3-methylpyridine-2-carboxylic acid;oxygen(2-);vanadium(4+)
CID 10058713
3-(2-methylphenyl)pyridine-2-carboxamide
CID 174495640
3-[2-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 52983947
3-(2-fluoro-5-methylphenyl)pyridine-2-carboxylic acid
CID 53222818
3-isoquinolin-5-ylpyridine-2-carboxylic acid
CID 107525025
3-pyridin-4-ylpyridine-2-carboxylic acid
CID 46316065
2-(4-methylnaphthalen-1-yl)phenol
CID 53405208

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid?
The IUPAC name of 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid (CID 107525274) is 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid is Cc1ccc(-c2cccnc2C(=O)O)c2ccccc12.
What is the InChIKey of 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid?
The InChIKey is AWGZQMIOLWBLIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2/c1-11-8-9-14(13-6-3-2-5-12(11)13)15-7-4-10-18-16(15)17(19)20/h2-10H,1H3,(H,19,20).
What are the key properties of 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid?
3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid has a molecular weight of 263.30 g/mol, XLogP of 3.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylnaphthalen-1-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 107525274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).