4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile
TL;DR: 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile (CAS 313668-36-9) is a chemical compound with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxyanilino)-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Also Known As: BAS 00883014, 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile, 2-(2-methoxyanilino)-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile, 4-(methoxymethyl)-2-[(2-methoxyphenyl)amino]-6-methylpyridine-3-carbonitrile, 4-(methoxymethyl)-2-((2-methoxyphenyl)amino)-6-methylnicotinonitrile
| Molecular Formula | C16H17N3O2 |
|---|---|
| Molecular Weight | 283.13 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.13208 |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 313668-36-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)NC2=CC=CC=C2OC)C#N)COC |
| InChIKey | WNJQVQSJLPJQCE-UHFFFAOYSA-N |
Product Overview
4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile (CAS 313668-36-9), with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol. IUPAC: 2-(2-methoxyanilino)-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile
Property Insights of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile
The XLogP value of 3.0 indicates that 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile. Following Lipinski's Rule of Five, 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile has 1 hydrogen bond donor(s) and 5 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 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile?
The CAS number of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile is 313668-36-9.
What is the molecular formula of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile?
The molecular formula of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile is C16H17N3O2.
What is the molecular weight of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile?
The molecular weight of 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile is 283.13 g/mol.
Where can I buy 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile?
You can request a quote for 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.