6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile
TL;DR: 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile (CAS 478049-79-5) is a chemical compound with molecular formula C9H8F3N3 and molecular weight 215.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: 6-methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile, 5N-395S, 6-methyl-2-(methylamino)-4-(trifluoromethyl)nicotinonitrile, 6-methyl-2-methylamino-4-(trifluoromethyl)pyridine-3-carbonitrile
| Molecular Formula | C9H8F3N3 |
|---|---|
| Molecular Weight | 215.07 g/mol |
| LogP | 2.3222 |
| Topological Polar Surface Area | 48.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.06703 |
| Heavy Atoms | 15 |
| Complexity | 417.83636 |
Chemical Identifiers
| CAS Number | 478049-79-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)NC)C#N)C(F)(F)F |
Product Overview
6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile (CAS 478049-79-5), with molecular formula C9H8F3N3 and molecular weight 215.07 g/mol. IUPAC: 6-methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile
Property Insights of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile
The XLogP value of 2.3222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile. With a topological polar surface area (TPSA) of 48.71 Ų, 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile has 1 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 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile?
The CAS number of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile is 478049-79-5.
What is the molecular formula of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile?
The molecular formula of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile is C9H8F3N3.
What is the molecular weight of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile?
The molecular weight of 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile is 215.07 g/mol.
Where can I buy 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile?
You can request a quote for 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-(methylamino)-4-(trifluoromethyl)pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.