4-(azepan-2-yl)-N,N-dimethylaniline
TL;DR: 4-(azepan-2-yl)-N,N-dimethylaniline (CAS 1185293-73-5) is a chemical compound with molecular formula C14H22N2 and molecular weight 218.1783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(azepan-2-yl)-N,N-dimethylaniline
Also Known As: 4-(azepan-2-yl)-N,N-dimethylaniline, -DIMETHYL-AMINE, 4-(2-Azepanyl)-N,N-dimethylaniline, (4-Azepan-2-yl-phenyl)-dimethyl-amine, 4-(azepan-2-yl)-N,N-dimethyl-aniline
Technical Specifications
| Molecular Formula | C14H22N2 |
| Molecular Weight | 218.1783 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.1783 Da |
| Heavy Atoms | 16 |
| Complexity | 195.0 |
| SMILES | CN(C)C1=CC=C(C=C1)C2CCCCCN2 |
| InChIKey | BMOCNWFSKKENGB-UHFFFAOYSA-N |
Chemical Property Profile of 4-(azepan-2-yl)-N,N-dimethylaniline
Property Insights of 4-(azepan-2-yl)-N,N-dimethylaniline
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(azepan-2-yl)-N,N-dimethylaniline. With a topological polar surface area (TPSA) of 15.3 Ų, 4-(azepan-2-yl)-N,N-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(azepan-2-yl)-N,N-dimethylaniline 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-(azepan-2-yl)-N,N-dimethylaniline?
The CAS number of 4-(azepan-2-yl)-N,N-dimethylaniline is 1185293-73-5.
What is the molecular formula of 4-(azepan-2-yl)-N,N-dimethylaniline?
The molecular formula of 4-(azepan-2-yl)-N,N-dimethylaniline is C14H22N2.
What is the molecular weight of 4-(azepan-2-yl)-N,N-dimethylaniline?
The molecular weight of 4-(azepan-2-yl)-N,N-dimethylaniline is 218.1783 g/mol.
Where can I buy 4-(azepan-2-yl)-N,N-dimethylaniline?
You can request a quote for 4-(azepan-2-yl)-N,N-dimethylaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(azepan-2-yl)-N,N-dimethylaniline?
Yes, CoreyChem provides custom synthesis services for 4-(azepan-2-yl)-N,N-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.