金刚乙胺
TL;DR: 金刚乙胺 (CAS 13392-28-4) is a chemical compound with molecular formula C12H21N and molecular weight 179.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
金刚乙胺
1-(1-adamantyl)ethanamine
Also Known As: rimantadine, 1-(1-Adamantyl)ethanamine, Rimantadina, Flumadine, Rimantadinum
| Molecular Formula | C12H21N |
|---|---|
| Molecular Weight | 179.17 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.1674 |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
| Melting Point | >300 °C |
| Solubility | Hydrochloride salt freely soluble (50 mg/ml at 20 °C) |
Chemical Identifiers
| CAS Number | 13392-28-4 |
|---|---|
| SMILES | CC(C12CC3CC(C1)CC(C3)C2)N |
| InChIKey | UBCHPRBFMUDMNC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
金刚乙胺 (CAS 13392-28-4), with molecular formula C12H21N and molecular weight 179.17 g/mol. IUPAC: 1-(1-adamantyl)ethanamine.
Chemical Property Profile of 金刚乙胺
Property Insights of 金刚乙胺
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 金刚乙胺. With a topological polar surface area (TPSA) of 26.0 Ų, 金刚乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 金刚乙胺 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 金刚乙胺?
The CAS number of 金刚乙胺 is 13392-28-4.
What is the molecular formula of 金刚乙胺?
The molecular formula of 金刚乙胺 is C12H21N.
What is the molecular weight of 金刚乙胺?
The molecular weight of 金刚乙胺 is 179.17 g/mol.
Where can I buy 金刚乙胺?
You can request a quote for 金刚乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 金刚乙胺?
Yes, KEHONG BIO provides custom synthesis services for 金刚乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.