4-methyl-N-(pyridin-3-ylmethyl)aniline
TL;DR: 4-methyl-N-(pyridin-3-ylmethyl)aniline (CAS 113248-79-6) is a chemical compound with molecular formula C13H14N2 and molecular weight 198.11569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-N-(pyridin-3-ylmethyl)aniline
Also Known As: 4-methyl-N-(pyridin-3-ylmethyl)aniline, starbld0025701, 4-methyl-N-(3-pyridylmethyl)aniline, 3-(4-methylphenylaminomethyl)pyridine, (4-methylphenyl)(3-pyridylmethyl)amine
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H14N2 |
| Molecular Weight | 198.11569 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 24.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.11569 Da |
| Heavy Atoms | 15 |
| Complexity | 173.0 |
| SMILES | CC1=CC=C(C=C1)NCC2=CN=CC=C2 |
| InChIKey | BBZDHSKNNFBFKH-UHFFFAOYSA-N |
Chemical Property Profile of 4-methyl-N-(pyridin-3-ylmethyl)aniline
Property Insights of 4-methyl-N-(pyridin-3-ylmethyl)aniline
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-(pyridin-3-ylmethyl)aniline. With a topological polar surface area (TPSA) of 24.9 Ų, 4-methyl-N-(pyridin-3-ylmethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-N-(pyridin-3-ylmethyl)aniline 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
What is the CAS number of 4-methyl-N-(pyridin-3-ylmethyl)aniline?
The CAS number of 4-methyl-N-(pyridin-3-ylmethyl)aniline is 113248-79-6.
What is the molecular formula of 4-methyl-N-(pyridin-3-ylmethyl)aniline?
The molecular formula of 4-methyl-N-(pyridin-3-ylmethyl)aniline is C13H14N2.
What is the molecular weight of 4-methyl-N-(pyridin-3-ylmethyl)aniline?
The molecular weight of 4-methyl-N-(pyridin-3-ylmethyl)aniline is 198.11569 g/mol.
Where can I buy 4-methyl-N-(pyridin-3-ylmethyl)aniline?
You can request a quote for 4-methyl-N-(pyridin-3-ylmethyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-methyl-N-(pyridin-3-ylmethyl)aniline?
Yes, CoreyChem provides custom synthesis services for 4-methyl-N-(pyridin-3-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.