2-(1-Adamantyl)-4-methylaniline
TL;DR: 2-(1-Adamantyl)-4-methylaniline (CAS 313500-69-5) is a chemical compound with molecular formula C17H23N and molecular weight 241.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-4-methylaniline
Also Known As: 2-(1-adamantyl)-4-methylaniline, 2-(Adamantan-1-yl)-4-methylaniline
| Molecular Formula | C17H23N |
|---|---|
| Molecular Weight | 241.18 g/mol |
| LogP | 4.04502 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.18304 |
| Heavy Atoms | 18 |
| Complexity | 453.09927 |
Chemical Identifiers
| CAS Number | 313500-69-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N)C23CC4CC(C2)CC(C4)C3 |
Product Overview
2-(1-Adamantyl)-4-methylaniline (CAS 313500-69-5), with molecular formula C17H23N and molecular weight 241.18 g/mol. IUPAC: 2-(1-adamantyl)-4-methylaniline.
Chemical Property Profile of 2-(1-Adamantyl)-4-methylaniline
Property Insights of 2-(1-Adamantyl)-4-methylaniline
The XLogP value of 4.04502 indicates that 2-(1-Adamantyl)-4-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 2-(1-Adamantyl)-4-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Adamantyl)-4-methylaniline 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
Frequently Asked Questions
What is the CAS number of 2-(1-Adamantyl)-4-methylaniline?
The CAS number of 2-(1-Adamantyl)-4-methylaniline is 313500-69-5.
What is the molecular formula of 2-(1-Adamantyl)-4-methylaniline?
The molecular formula of 2-(1-Adamantyl)-4-methylaniline is C17H23N.
What is the molecular weight of 2-(1-Adamantyl)-4-methylaniline?
The molecular weight of 2-(1-Adamantyl)-4-methylaniline is 241.18 g/mol.
Where can I buy 2-(1-Adamantyl)-4-methylaniline?
You can request a quote for 2-(1-Adamantyl)-4-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Adamantyl)-4-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Adamantyl)-4-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.