ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate
TL;DR: ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate (CAS 108392-76-3) is a chemical compound with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate
Also Known As: Ethyl (s)-2-(pyridin-3-yl)pyrrolidine-1-carboxylate, ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate, ethyl (2S)-2-(3-pyridyl)pyrrolidine-1-carboxylate, ethyl (2S)-2-(pyridin-3-yl)pyrrolidine-1-carboxylate, 1-Pyrrolidinecarboxylic acid, 2-(3-pyridinyl)-, ethyl ester, (2S)-
| Molecular Formula | C12H16N2O2 |
|---|---|
| Molecular Weight | 220.12 g/mol |
| LogP | 2.375 |
| Topological Polar Surface Area | 42.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.12119 |
| Heavy Atoms | 16 |
| Complexity | 353.2962 |
Chemical Identifiers
| CAS Number | 108392-76-3 |
|---|---|
| SMILES | CCOC(=O)N1CCC[C@H]1C2=CN=CC=C2 |
Product Overview
ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate (CAS 108392-76-3), with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol. IUPAC: ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate.
Chemical Property Profile of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate
Property Insights of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate
The XLogP value of 2.375 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate. With a topological polar surface area (TPSA) of 42.43 Ų, ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate has 0 hydrogen bond donor(s) and 3 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 (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate?
The CAS number of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate is 108392-76-3.
What is the molecular formula of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate?
The molecular formula of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate is C12H16N2O2.
What is the molecular weight of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate?
The molecular weight of ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate is 220.12 g/mol.
Where can I buy ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate?
You can request a quote for ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (2S)-2-pyridin-3-ylpyrrolidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.