4-Adamantan-1-yl-2-methyl-phenylamine
TL;DR: 4-Adamantan-1-yl-2-methyl-phenylamine (CAS 22947-40-6) 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.
4-(1-adamantyl)-2-methylaniline
Also Known As: 4-(1-adamantyl)-2-methylaniline, 4-Adamantan-1-yl-2-methyl-phenylamine, BB 0217081, AB00983463-01, 2-methyl-4-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]aniline
| 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 | 22947-40-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C23CC4CC(C2)CC(C4)C3)N |
Product Overview
4-Adamantan-1-yl-2-methyl-phenylamine (CAS 22947-40-6), with molecular formula C17H23N and molecular weight 241.18 g/mol. IUPAC: 4-(1-adamantyl)-2-methylaniline.
Chemical Property Profile of 4-Adamantan-1-yl-2-methyl-phenylamine
Property Insights of 4-Adamantan-1-yl-2-methyl-phenylamine
The XLogP value of 4.04502 indicates that 4-Adamantan-1-yl-2-methyl-phenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 4-Adamantan-1-yl-2-methyl-phenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Adamantan-1-yl-2-methyl-phenylamine 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 4-Adamantan-1-yl-2-methyl-phenylamine?
The CAS number of 4-Adamantan-1-yl-2-methyl-phenylamine is 22947-40-6.
What is the molecular formula of 4-Adamantan-1-yl-2-methyl-phenylamine?
The molecular formula of 4-Adamantan-1-yl-2-methyl-phenylamine is C17H23N.
What is the molecular weight of 4-Adamantan-1-yl-2-methyl-phenylamine?
The molecular weight of 4-Adamantan-1-yl-2-methyl-phenylamine is 241.18 g/mol.
Where can I buy 4-Adamantan-1-yl-2-methyl-phenylamine?
You can request a quote for 4-Adamantan-1-yl-2-methyl-phenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Adamantan-1-yl-2-methyl-phenylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Adamantan-1-yl-2-methyl-phenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.