Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester
TL;DR: Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester (CAS 842972-16-1) is a chemical compound with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2-methylcyclohexyl)amino]-2-oxoethyl] pyridine-2-carboxylate
Also Known As: BAS 07228391, Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester, [N-(2-methylcyclohexyl)carbamoyl]methyl pyridine-2-carboxylate, 2-[(2-Methylcyclohexyl)amino]-2-oxoethyl 2-pyridinecarboxylate, [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] pyridine-2-carboxylate
| Molecular Formula | C15H20N2O3 |
|---|---|
| Molecular Weight | 276.15 g/mol |
| LogP | 1.9333 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.1474 |
| Heavy Atoms | 20 |
| Complexity | 461.44626 |
Chemical Identifiers
| CAS Number | 842972-16-1 |
|---|---|
| SMILES | CC1CCCCC1NC(=O)COC(=O)C2=CC=CC=N2 |
Product Overview
Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester (CAS 842972-16-1), with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol. IUPAC: [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] pyridine-2-carboxylate.
Chemical Property Profile of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester
Property Insights of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester
The XLogP value of 1.9333 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester. Following Lipinski's Rule of Five, Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester has 1 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 Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester?
The CAS number of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester is 842972-16-1.
What is the molecular formula of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester?
The molecular formula of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester is C15H20N2O3.
What is the molecular weight of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester?
The molecular weight of Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester is 276.15 g/mol.
Where can I buy Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester?
You can request a quote for Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Pyridine-2-carboxylic acid (2-methyl-cyclohexylcarbamoyl)-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.