Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate
TL;DR: Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate (CAS 397245-55-5) is a chemical compound with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate
Also Known As: Peakdale1_000877, Methyl 6-[2-(pyrrolidin-1-yl)ethyl]nicotinate, methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate
| Molecular Formula | C13H18N2O2 |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 1.5065 |
| Topological Polar Surface Area | 42.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.13683 |
| Heavy Atoms | 17 |
| Complexity | 369.51077 |
Chemical Identifiers
| CAS Number | 397245-55-5 |
|---|---|
| SMILES | COC(=O)C1=CN=C(C=C1)CCN2CCCC2 |
Product Overview
Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate (CAS 397245-55-5), with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol. IUPAC: methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate.
Chemical Property Profile of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate
Property Insights of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate
The XLogP value of 1.5065 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate. With a topological polar surface area (TPSA) of 42.43 Ų, Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate has 0 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 Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate?
The CAS number of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate is 397245-55-5.
What is the molecular formula of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate?
The molecular formula of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate is C13H18N2O2.
What is the molecular weight of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate?
The molecular weight of Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate is 234.14 g/mol.
Where can I buy Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate?
You can request a quote for Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 6-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.