2-Methoxy-4,6-dimethylnicotinonitrile
TL;DR: 2-Methoxy-4,6-dimethylnicotinonitrile (CAS 65515-39-1) is a chemical compound with molecular formula C9H10N2O and molecular weight 162.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-4,6-dimethylpyridine-3-carbonitrile
Also Known As: 2-Methoxy-4,6-dimethylnicotinonitrile, 2-methoxy-4,6-dimethylpyridine-3-carbonitrile, Maybridge1_006023, methoxydimethylnicotinonitrile, 3-cyano-2-methoxy-4,6-dimethylpyridine
| Molecular Formula | C9H10N2O |
|---|---|
| Molecular Weight | 162.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 45.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.07932 |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 65515-39-1 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)OC)C |
| InChIKey | WEJLKGQPSKTCBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxy-4,6-dimethylnicotinonitrile (CAS 65515-39-1), with molecular formula C9H10N2O and molecular weight 162.08 g/mol. IUPAC: 2-methoxy-4,6-dimethylpyridine-3-carbonitrile.
Chemical Property Profile of 2-Methoxy-4,6-dimethylnicotinonitrile
Property Insights of 2-Methoxy-4,6-dimethylnicotinonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-4,6-dimethylnicotinonitrile. With a topological polar surface area (TPSA) of 45.9 Ų, 2-Methoxy-4,6-dimethylnicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-4,6-dimethylnicotinonitrile has 0 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 2-Methoxy-4,6-dimethylnicotinonitrile?
The CAS number of 2-Methoxy-4,6-dimethylnicotinonitrile is 65515-39-1.
What is the molecular formula of 2-Methoxy-4,6-dimethylnicotinonitrile?
The molecular formula of 2-Methoxy-4,6-dimethylnicotinonitrile is C9H10N2O.
What is the molecular weight of 2-Methoxy-4,6-dimethylnicotinonitrile?
The molecular weight of 2-Methoxy-4,6-dimethylnicotinonitrile is 162.08 g/mol.
Where can I buy 2-Methoxy-4,6-dimethylnicotinonitrile?
You can request a quote for 2-Methoxy-4,6-dimethylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-4,6-dimethylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-4,6-dimethylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.