Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate
TL;DR: Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate (CAS 303146-75-0) is a chemical compound with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-cyano-2-methyl-6-pyrrolidin-1-ylpyridine-3-carboxylate
Also Known As: methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate, 11K-383S, methyl 5-cyano-2-methyl-6-(pyrrolidin-1-yl)pyridine-3-carboxylate, methyl 5-cyano-2-methyl-6-pyrrolidin-1-ylpyridine-3-carboxylate, Methyl 5-cyano-2-methyl-6-pyrrolidin-1-yl-pyridine-3-carboxylate
| Molecular Formula | C13H15N3O2 |
|---|---|
| Molecular Weight | 245.12 g/mol |
| LogP | 1.6485 |
| Topological Polar Surface Area | 66.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.11642 |
| Heavy Atoms | 18 |
| Complexity | 513.703 |
Chemical Identifiers
| CAS Number | 303146-75-0 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)N2CCCC2)C#N)C(=O)OC |
Product Overview
Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate (CAS 303146-75-0), with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol. IUPAC: methyl 5-cyano-2-methyl-6-pyrrolidin-1-ylpyridine-3-carboxylate.
Chemical Property Profile of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate
Property Insights of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate
The XLogP value of 1.6485 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate. The TPSA of 66.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate. Following Lipinski's Rule of Five, Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate has 0 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 Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate?
The CAS number of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate is 303146-75-0.
What is the molecular formula of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate?
The molecular formula of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate is C13H15N3O2.
What is the molecular weight of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate?
The molecular weight of Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate is 245.12 g/mol.
Where can I buy Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate?
You can request a quote for Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-cyano-2-methyl-6-(1-pyrrolidinyl)nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.