1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine
TL;DR: 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine (CAS 108114-93-8) is a chemical compound with molecular formula C12H16N2 and molecular weight 188.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline
Also Known As: 2'-NH2-Mptp, 2'-Amino-MPTP, starbld0002585, 2 -Amino-MPTP, 2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline
| Molecular Formula | C12H16N2 |
|---|---|
| Molecular Weight | 188.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.13135 |
| Heavy Atoms | 14 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 108114-93-8 |
|---|---|
| SMILES | CN1CCC(=CC1)C2=CC=CC=C2N |
| InChIKey | BRFNXNYQQYJJAQ-UHFFFAOYSA-N |
Product Overview
1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine (CAS 108114-93-8), with molecular formula C12H16N2 and molecular weight 188.13 g/mol. IUPAC: 2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline.
Chemical Property Profile of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine
Property Insights of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine. With a topological polar surface area (TPSA) of 29.3 Ų, 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine has 1 hydrogen bond donor(s) and 2 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-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine?
The CAS number of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine is 108114-93-8.
What is the molecular formula of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine?
The molecular formula of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine is C12H16N2.
What is the molecular weight of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine?
The molecular weight of 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine is 188.13 g/mol.
Where can I buy 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine?
You can request a quote for 1-Methyl-4-(2'-aminophenyl)-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-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-(2'-aminophenyl)-1,2,3,6-tetrahydropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.