3-(1-Adamantyl)-4-methoxyaniline
TL;DR: 3-(1-Adamantyl)-4-methoxyaniline (CAS 142651-04-5) is a chemical compound with molecular formula C17H23NO and molecular weight 257.17798 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1-adamantyl)-4-methoxyaniline
Also Known As: 3-(1-adamantyl)-4-methoxyaniline, 3-(Adamantan-1-yl)-4-methoxyaniline, 3-(1-Adamantyl)-4-methoxyphenylamine, 3-adamantanyl-4-methoxyphenylamine, 3-(1-adamantyl)-4-methoxy-aniline
Technical Specifications
| Molecular Formula | C17H23NO |
| Molecular Weight | 257.17798 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.17798 Da |
| Heavy Atoms | 19 |
| Complexity | 312.0 |
| SMILES | COC1=C(C=C(C=C1)N)C23CC4CC(C2)CC(C4)C3 |
| InChIKey | XCVZCOICYRDSHE-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1-Adamantyl)-4-methoxyaniline
Property Insights of 3-(1-Adamantyl)-4-methoxyaniline
The XLogP value of 4.6 indicates that 3-(1-Adamantyl)-4-methoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.3 Ų, 3-(1-Adamantyl)-4-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Adamantyl)-4-methoxyaniline 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 3-(1-Adamantyl)-4-methoxyaniline?
The CAS number of 3-(1-Adamantyl)-4-methoxyaniline is 142651-04-5.
What is the molecular formula of 3-(1-Adamantyl)-4-methoxyaniline?
The molecular formula of 3-(1-Adamantyl)-4-methoxyaniline is C17H23NO.
What is the molecular weight of 3-(1-Adamantyl)-4-methoxyaniline?
The molecular weight of 3-(1-Adamantyl)-4-methoxyaniline is 257.17798 g/mol.
Where can I buy 3-(1-Adamantyl)-4-methoxyaniline?
You can request a quote for 3-(1-Adamantyl)-4-methoxyaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1-Adamantyl)-4-methoxyaniline?
Yes, CoreyChem provides custom synthesis services for 3-(1-Adamantyl)-4-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.