![3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile structure](/static/products/266/26630-16-0.png)
3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile
TL;DR: 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile (CAS 26630-16-0) is a chemical compound with molecular formula C12H19N3O and molecular weight 221.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-morpholin-4-yl-1-azabicyclo[2.2.2]octane-3-carbonitrile
Also Known As: 3-morpholino-3-cyanoquinuclidine, BAS 03662529, 3-morpholinoquinuclidine-3-carbonitrile, 3-(4-morpholinyl)quinuclidine-3-carbonitrile, AH-262/36520002
| Molecular Formula | C12H19N3O |
|---|---|
| Molecular Weight | 221.15 g/mol |
| LogP | 0.30658 |
| Topological Polar Surface Area | 39.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.15282 |
| Heavy Atoms | 16 |
| Complexity | 299.87595 |
Chemical Identifiers
| CAS Number | 26630-16-0 |
|---|---|
| SMILES | C1CN2CCC1C(C2)(C#N)N3CCOCC3 |
Product Overview
3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile (CAS 26630-16-0), with molecular formula C12H19N3O and molecular weight 221.15 g/mol. IUPAC: 3-morpholin-4-yl-1-azabicyclo[2.2.2]octane-3-carbonitrile.
Chemical Property Profile of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile
Property Insights of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile
The XLogP value of 0.30658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile. With a topological polar surface area (TPSA) of 39.5 Ų, 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile 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 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile?
The CAS number of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile is 26630-16-0.
What is the molecular formula of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile?
The molecular formula of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile is C12H19N3O.
What is the molecular weight of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile?
The molecular weight of 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile is 221.15 g/mol.
Where can I buy 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile?
You can request a quote for 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(Morpholin-4-yl)-1-azabicyclo[2.2.2]octane-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.