2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile
TL;DR: 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile (CAS 53979-06-9) is a chemical compound with molecular formula C12H20N2O2 and molecular weight 224.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-4-morpholin-4-yloxane-4-carbonitrile
Also Known As: 2,2-dimethyl-4-morpholin-4-yloxane-4-carbonitrile, 2,2-dimethyl-4-morpholinotetrahydro-2H-pyran-4-carbonitrile, 2,2-dimethyl-4-(4-morpholinyl)tetrahydro-2H-pyran-4-carbonitrile, 2,2-dimethyl-4-(morpholin-4-yl)tetrahydro-2H-pyran-4-carbonitrile, 2,2-dimethyl-4-morpholin-4-yl-2H-3,4,5,6-tetrahydropyran-4-carbonitrile
| Molecular Formula | C12H20N2O2 |
|---|---|
| Molecular Weight | 224.15 g/mol |
| LogP | 1.16998 |
| Topological Polar Surface Area | 45.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.15248 |
| Heavy Atoms | 16 |
| Complexity | 291.88412 |
Chemical Identifiers
| CAS Number | 53979-06-9 |
|---|---|
| SMILES | CC1(CC(CCO1)(C#N)N2CCOCC2)C |
Product Overview
2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile (CAS 53979-06-9), with molecular formula C12H20N2O2 and molecular weight 224.15 g/mol. IUPAC: 2,2-dimethyl-4-morpholin-4-yloxane-4-carbonitrile.
Chemical Property Profile of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile
Property Insights of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile
The XLogP value of 1.16998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile. With a topological polar surface area (TPSA) of 45.49 Ų, 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethyl-4-morpholin-4-yloxane-4-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 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile?
The CAS number of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile is 53979-06-9.
What is the molecular formula of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile?
The molecular formula of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile is C12H20N2O2.
What is the molecular weight of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile?
The molecular weight of 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile is 224.15 g/mol.
Where can I buy 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile?
You can request a quote for 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-4-morpholin-4-yloxane-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.