2-(3-Methylbenzyl)pyrrolidine
TL;DR: 2-(3-Methylbenzyl)pyrrolidine (CAS 112565-42-1) is a chemical compound with molecular formula C12H17N and molecular weight 175.1361 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3-methylphenyl)methyl]pyrrolidine
Also Known As: 2-(3-methylbenzyl)pyrrolidine, 2-[(3-methylphenyl)methyl]pyrrolidine, 2-(m-Tolylmethyl)pyrrolidine, bis(trimethylsilyl)phosphite, 2-(3-Methyl-benzyl)-pyrrolidine
Technical Specifications
| Molecular Formula | C12H17N |
| Molecular Weight | 175.1361 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.1361 Da |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
| SMILES | CC1=CC(=CC=C1)CC2CCCN2 |
| InChIKey | UAEQLPGVHXUHDC-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Methylbenzyl)pyrrolidine
Property Insights of 2-(3-Methylbenzyl)pyrrolidine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Methylbenzyl)pyrrolidine. With a topological polar surface area (TPSA) of 12.0 Ų, 2-(3-Methylbenzyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Methylbenzyl)pyrrolidine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3-Methylbenzyl)pyrrolidine?
The CAS number of 2-(3-Methylbenzyl)pyrrolidine is 112565-42-1.
What is the molecular formula of 2-(3-Methylbenzyl)pyrrolidine?
The molecular formula of 2-(3-Methylbenzyl)pyrrolidine is C12H17N.
What is the molecular weight of 2-(3-Methylbenzyl)pyrrolidine?
The molecular weight of 2-(3-Methylbenzyl)pyrrolidine is 175.1361 g/mol.
Where can I buy 2-(3-Methylbenzyl)pyrrolidine?
You can request a quote for 2-(3-Methylbenzyl)pyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Methylbenzyl)pyrrolidine?
Yes, CoreyChem provides custom synthesis services for 2-(3-Methylbenzyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.