TL;DR: 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid (CAS 114501-02-9) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methoxyanilino)pyridine-3-carboxylic acid
Also Known As: 2-((2-Methoxyphenyl)amino)nicotinic acid, 2-[(2-methoxyphenyl)amino]nicotinic acid, 2-(2-Methoxy-phenylamino)-nicotinic acid, 2-anisidinonicotinic acid, 2-(2-methoxyanilino)pyridine-3-carboxylic acid
| Molecular Formula | C13H12N2O3 |
| Molecular Weight | 244.0848 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 71.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.0848 Da |
| Heavy Atoms | 18 |
| Complexity | 285.0 |
| SMILES | COC1=CC=CC=C1NC2=C(C=CC=N2)C(=O)O |
| InChIKey | BEXZOAJWOZFOSM-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid. Following Lipinski's Rule of Five, 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid is 114501-02-9.
The molecular formula of 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid is C13H12N2O3.
The molecular weight of 2-[(2-Methoxyphenyl)amino]pyridine-3-carboxylic acid is 244.0848 g/mol.
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