![1-Azabicyclo[2.2.2]octane, 4-methyl- structure](/static/products/4565/45651-41-0.webp)
1-Azabicyclo[2.2.2]octane, 4-methyl-
TL;DR: 1-Azabicyclo[2.2.2]octane, 4-methyl- (CAS 45651-41-0) 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.
4-methyl-1-azabicyclo[2.2.2]octane
Also Known As: 4-Methylquinuclidine, Q ME, 4-Methyl-1-azabicyclo[2.2.2]octane, 4-methyl-quinuclidine, 1-Azabicyclo(2.2.2)octane, 4-methyl-
| Molecular Formula | C8H15N |
|---|---|
| Molecular Weight | 125.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.12045 |
| Heavy Atoms | 9 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 45651-41-0 |
|---|---|
| SMILES | CC12CCN(CC1)CC2 |
| InChIKey | DLHGEIMBTIHQGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Azabicyclo[2.2.2]octane, 4-methyl- (CAS 45651-41-0), with molecular formula C8H15N and molecular weight 125.12 g/mol. IUPAC: 4-methyl-1-azabicyclo[2.2.2]octane.
Chemical Property Profile of 1-Azabicyclo[2.2.2]octane, 4-methyl-
Property Insights of 1-Azabicyclo[2.2.2]octane, 4-methyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Azabicyclo[2.2.2]octane, 4-methyl-. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Azabicyclo[2.2.2]octane, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azabicyclo[2.2.2]octane, 4-methyl- 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 1-Azabicyclo[2.2.2]octane, 4-methyl-?
The CAS number of 1-Azabicyclo[2.2.2]octane, 4-methyl- is 45651-41-0.
What is the molecular formula of 1-Azabicyclo[2.2.2]octane, 4-methyl-?
The molecular formula of 1-Azabicyclo[2.2.2]octane, 4-methyl- is C8H15N.
What is the molecular weight of 1-Azabicyclo[2.2.2]octane, 4-methyl-?
The molecular weight of 1-Azabicyclo[2.2.2]octane, 4-methyl- is 125.12 g/mol.
Where can I buy 1-Azabicyclo[2.2.2]octane, 4-methyl-?
You can request a quote for 1-Azabicyclo[2.2.2]octane, 4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Azabicyclo[2.2.2]octane, 4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Azabicyclo[2.2.2]octane, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.