5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid

C14H13NO4 — CID 53211472

IUPAC5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid
SMILESCOc1ccc(OC)c(-c2ccc(C(=O)O)nc2)c1
InChIInChI=1S/C14H13NO4/c1-18-10-4-6-13(19-2)11(7-10)9-3-5-12(14(16)17)15-8-9/h3-8H,1-2H3,(H,16,17)
InChIKeyGLHARYJNHKKWBK-UHFFFAOYSA-N
MW259.26 g/mol
LogP2.46
Rot. Bonds4

About 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid

5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid (PubChem CID 53211472) has the molecular formula C14H13NO4 and a molecular weight of 259.26 g/mol. Its IUPAC name is 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid
PubChem CID53211472
Molecular FormulaC14H13NO4
Molecular Weight259.26 g/mol
Exact Mass259.08
IUPAC Name5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid
SMILESCOc1ccc(OC)c(-c2ccc(C(=O)O)nc2)c1
InChIInChI=1S/C14H13NO4/c1-18-10-4-6-13(19-2)11(7-10)9-3-5-12(14(16)17)15-8-9/h3-8H,1-2H3,(H,16,17)
InChIKeyGLHARYJNHKKWBK-UHFFFAOYSA-N
XLogP2.46
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(2,5-dimethoxyphenyl)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

5-(4-methoxyphenyl)pyridine-2-carboxylic acid
CID 52983912
2-[4-(2,5-dimethoxyphenyl)phenyl]-1,4-dimethoxybenzene
CID 172792841
6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 42878553
5-(5-methoxy-1,3-benzothiazol-2-yl)pyridine-2-carboxylic acid
CID 134434727
4-(2,5-dimethoxyphenyl)pyrimidine-5-carboxylic acid
CID 82484332
5-(2,5-dimethoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 53223755
3-amino-5-(2,5-dimethoxyphenyl)benzoic acid
CID 53227230
4-(2,5-dimethoxyphenyl)-2-methylphenol
CID 53219026
2-[4-(2,5-dimethoxyphenyl)pyrazol-1-yl]acetic acid
CID 82121885
4-[4-(2,5-dimethoxyphenyl)phenyl]piperazine-1-carboxylic acid
CID 69366638
1-[4-(2,5-dimethoxyphenyl)phenyl]cyclopropane-1-carboxylic acid
CID 82039519
5-(2,5-dimethoxyphenyl)pyridin-3-ol
CID 53217947

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid?
The IUPAC name of 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid (CID 53211472) is 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid?
The canonical SMILES for 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid is COc1ccc(OC)c(-c2ccc(C(=O)O)nc2)c1.
What is the InChIKey of 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid?
The InChIKey is GLHARYJNHKKWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO4/c1-18-10-4-6-13(19-2)11(7-10)9-3-5-12(14(16)17)15-8-9/h3-8H,1-2H3,(H,16,17).
What are the key properties of 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid?
5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid has a molecular weight of 259.26 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 53211472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).