1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine
TL;DR: 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine (CAS 107535-00-2) is a chemical compound with molecular formula C13H17N and molecular weight 187.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-(4-methylphenyl)-3,6-dihydro-2H-pyridine
Also Known As: 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine, 1-methyl-2-(4-methylphenyl)-3,6-dihydro-2H-pyridine, Pyridine, 1,2,3,6-tetrahydro-1-methyl-2-(4-methylphenyl)-
| Molecular Formula | C13H17N |
|---|---|
| Molecular Weight | 187.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.1361 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 107535-00-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC=CCN2C |
| InChIKey | LRYSGYSXRKQAMN-UHFFFAOYSA-N |
Product Overview
1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine (CAS 107535-00-2), with molecular formula C13H17N and molecular weight 187.14 g/mol. IUPAC: 1-methyl-2-(4-methylphenyl)-3,6-dihydro-2H-pyridine.
Chemical Property Profile of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine
Property Insights of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine has 0 hydrogen bond donor(s) and 1 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 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine?
The CAS number of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine is 107535-00-2.
What is the molecular formula of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine?
The molecular formula of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine is C13H17N.
What is the molecular weight of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine?
The molecular weight of 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine is 187.14 g/mol.
Where can I buy 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine?
You can request a quote for 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-(4-methylphenyl)-1,2,3,6-tetrahydropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.