![2-[(3-Pyridinylmethyl)amino]nicotinic acid structure](/static/products/4603/460363-72-8.webp)
2-[(3-Pyridinylmethyl)amino]nicotinic acid
TL;DR: 2-[(3-Pyridinylmethyl)amino]nicotinic acid (CAS 460363-72-8) is a chemical compound with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethylamino)pyridine-3-carboxylic acid
Also Known As: 2-[(3-PYRIDINYLMETHYL)AMINO]NICOTINIC ACID, 2-((Pyridin-3-ylmethyl)amino)nicotinic acid, 2-(pyridin-3-ylmethylamino)pyridine-3-carboxylic Acid, 2-((Pyridin-3-ylmethyl)amino)nicotinicacid, 2-[(pyridin-3-ylmethyl)amino]pyridine-3-carboxylic acid
| Molecular Formula | C12H11N3O2 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 1.7869 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.08513 |
| Heavy Atoms | 17 |
| Complexity | 514.169 |
Chemical Identifiers
| CAS Number | 460363-72-8 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC2=C(C=CC=N2)C(=O)O |
Product Overview
2-[(3-Pyridinylmethyl)amino]nicotinic acid (CAS 460363-72-8), with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol. IUPAC: 2-(pyridin-3-ylmethylamino)pyridine-3-carboxylic acid.
Chemical Property Profile of 2-[(3-Pyridinylmethyl)amino]nicotinic acid
Property Insights of 2-[(3-Pyridinylmethyl)amino]nicotinic acid
The XLogP value of 1.7869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Pyridinylmethyl)amino]nicotinic acid. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Pyridinylmethyl)amino]nicotinic acid. Following Lipinski's Rule of Five, 2-[(3-Pyridinylmethyl)amino]nicotinic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(3-Pyridinylmethyl)amino]nicotinic acid?
The CAS number of 2-[(3-Pyridinylmethyl)amino]nicotinic acid is 460363-72-8.
What is the molecular formula of 2-[(3-Pyridinylmethyl)amino]nicotinic acid?
The molecular formula of 2-[(3-Pyridinylmethyl)amino]nicotinic acid is C12H11N3O2.
What is the molecular weight of 2-[(3-Pyridinylmethyl)amino]nicotinic acid?
The molecular weight of 2-[(3-Pyridinylmethyl)amino]nicotinic acid is 229.09 g/mol.
Where can I buy 2-[(3-Pyridinylmethyl)amino]nicotinic acid?
You can request a quote for 2-[(3-Pyridinylmethyl)amino]nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Pyridinylmethyl)amino]nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Pyridinylmethyl)amino]nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.