2-Ethyl-2-azabicyclo(2.2.1)heptane
TL;DR: 2-Ethyl-2-azabicyclo(2.2.1)heptane (CAS 4492-38-0) is a chemical compound with molecular formula C8H15N and molecular weight 125.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-2-azabicyclo[2.2.1]heptane
Also Known As: 2-Ethyl-2-azabicyclo(2.2.1)heptane, 2-Ethyl-2-azabicyclo[2.2.1]heptane, 2-Azabicyclo[2.2.1]heptane, 2-ethyl-, 3-ethyl-3-azabicyclo[2.2.1]heptane, 2-AZABICYCLO(2.2.1)HEPTANE, 2-ETHYL-
| Molecular Formula | C8H15N |
|---|---|
| Molecular Weight | 125.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.12045 |
| Heavy Atoms | 9 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 4492-38-0 |
|---|---|
| SMILES | CCN1CC2CCC1C2 |
| InChIKey | WCBKFFPLWHRVII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethyl-2-azabicyclo(2.2.1)heptane (CAS 4492-38-0), with molecular formula C8H15N and molecular weight 125.12 g/mol. IUPAC: 2-ethyl-2-azabicyclo[2.2.1]heptane.
Chemical Property Profile of 2-Ethyl-2-azabicyclo(2.2.1)heptane
Property Insights of 2-Ethyl-2-azabicyclo(2.2.1)heptane
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-2-azabicyclo(2.2.1)heptane. With a topological polar surface area (TPSA) of 3.2 Ų, 2-Ethyl-2-azabicyclo(2.2.1)heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-2-azabicyclo(2.2.1)heptane has 0 hydrogen bond donor(s) and 1 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 2-Ethyl-2-azabicyclo(2.2.1)heptane?
The CAS number of 2-Ethyl-2-azabicyclo(2.2.1)heptane is 4492-38-0.
What is the molecular formula of 2-Ethyl-2-azabicyclo(2.2.1)heptane?
The molecular formula of 2-Ethyl-2-azabicyclo(2.2.1)heptane is C8H15N.
What is the molecular weight of 2-Ethyl-2-azabicyclo(2.2.1)heptane?
The molecular weight of 2-Ethyl-2-azabicyclo(2.2.1)heptane is 125.12 g/mol.
Where can I buy 2-Ethyl-2-azabicyclo(2.2.1)heptane?
You can request a quote for 2-Ethyl-2-azabicyclo(2.2.1)heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-2-azabicyclo(2.2.1)heptane?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-2-azabicyclo(2.2.1)heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.