Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate
TL;DR: Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate (CAS 137522-47-5) is a chemical compound with molecular formula C10H11N3O2 and molecular weight 205.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate
Also Known As: ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate, Ethyl 6-amino-5-cyano-2-methylnicotinate, J2.869.222F, 2-Methyl-5-cyano-6-aminonicotinic acid ethyl ester, 3-Pyridinecarboxylicacid,6-amino-5-cyano-2-methyl-,ethylester(9CI)
| Molecular Formula | C10H11N3O2 |
|---|---|
| Molecular Weight | 205.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 89.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.08513 |
| Heavy Atoms | 15 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 137522-47-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(C(=C1)C#N)N)C |
| InChIKey | BBBXNFJPLSWDRO-UHFFFAOYSA-N |
Product Overview
Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate (CAS 137522-47-5), with molecular formula C10H11N3O2 and molecular weight 205.09 g/mol. IUPAC: ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate.
Chemical Property Profile of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate
Property Insights of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate 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 Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate?
The CAS number of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate is 137522-47-5.
What is the molecular formula of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate?
The molecular formula of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate is C10H11N3O2.
What is the molecular weight of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate?
The molecular weight of Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate is 205.09 g/mol.
Where can I buy Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate?
You can request a quote for Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-amino-5-cyano-2-methylpyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.