3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester
TL;DR: 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester (CAS 69451-78-1) is a chemical compound with molecular formula C17H19N3O3 and molecular weight 313.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridine-3-carbonylamino)pentyl pyridine-3-carboxylate
Also Known As: 2-((3-Pyridinylcarbonyl)amino)pentyl 3-pyridinecarboxylate, 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester, 2-(pyridine-3-carbonylamino)pentyl pyridine-3-carboxylate, N-{1-[(Pyridine-3-carbonyl)oxy]pentan-2-yl}pyridine-3-carboximidic acid, BRN 5599403
| Molecular Formula | C17H19N3O3 |
|---|---|
| Molecular Weight | 313.14 g/mol |
| LogP | 2.2321 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 313.14264 |
| Heavy Atoms | 23 |
| Complexity | 632.0466 |
Chemical Identifiers
| CAS Number | 69451-78-1 |
|---|---|
| SMILES | CCCC(COC(=O)C1=CN=CC=C1)NC(=O)C2=CN=CC=C2 |
Product Overview
3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester (CAS 69451-78-1), with molecular formula C17H19N3O3 and molecular weight 313.14 g/mol. IUPAC: 2-(pyridine-3-carbonylamino)pentyl pyridine-3-carboxylate.
Chemical Property Profile of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester
Property Insights of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester
The XLogP value of 2.2321 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester. Following Lipinski's Rule of Five, 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester has 1 hydrogen bond donor(s) and 5 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 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester?
The CAS number of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester is 69451-78-1.
What is the molecular formula of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester?
The molecular formula of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester is C17H19N3O3.
What is the molecular weight of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester?
The molecular weight of 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester is 313.14 g/mol.
Where can I buy 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester?
You can request a quote for 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)pentyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.