3-(2-Bocaminoethyl)pyridine
TL;DR: 3-(2-Bocaminoethyl)pyridine (CAS 215305-99-0) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(2-pyridin-3-ylethyl)carbamate
Also Known As: 3- pyridine, 3-(2-boc-aminoethyl)pyridine, 3-(2-Bocaminoethyl)pyridine, Tert-butyl N-(2-pyridin-3-ylethyl)carbamate, 1,1-Dimethylethyl N-[2-(3-pyridinyl)ethyl]carbamate
| Molecular Formula | C12H18N2O2 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 2.1488 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.13683 |
| Heavy Atoms | 16 |
| Complexity | 330.62204 |
Chemical Identifiers
| CAS Number | 215305-99-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCC1=CN=CC=C1 |
Product Overview
3-(2-Bocaminoethyl)pyridine (CAS 215305-99-0), with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol. IUPAC: tert-butyl N-(2-pyridin-3-ylethyl)carbamate.
Chemical Property Profile of 3-(2-Bocaminoethyl)pyridine
Property Insights of 3-(2-Bocaminoethyl)pyridine
The XLogP value of 2.1488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Bocaminoethyl)pyridine. With a topological polar surface area (TPSA) of 51.22 Ų, 3-(2-Bocaminoethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Bocaminoethyl)pyridine has 1 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 3-(2-Bocaminoethyl)pyridine?
The CAS number of 3-(2-Bocaminoethyl)pyridine is 215305-99-0.
What is the molecular formula of 3-(2-Bocaminoethyl)pyridine?
The molecular formula of 3-(2-Bocaminoethyl)pyridine is C12H18N2O2.
What is the molecular weight of 3-(2-Bocaminoethyl)pyridine?
The molecular weight of 3-(2-Bocaminoethyl)pyridine is 222.14 g/mol.
Where can I buy 3-(2-Bocaminoethyl)pyridine?
You can request a quote for 3-(2-Bocaminoethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Bocaminoethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Bocaminoethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.