Adamantane, 1-(2-methylaminoethyl)-, hydrochloride
TL;DR: Adamantane, 1-(2-methylaminoethyl)-, hydrochloride (CAS 31897-97-9) is a chemical compound with molecular formula C13H24ClN and molecular weight 229.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-N-methylethanamine;hydrochloride
Also Known As: 1-(2-METHYLAMINOETHYL)ADAMANTANE HYDROCHLORIDE, [2-(1-Adamantyl)ethyl]methylamine hydrochloride, Ethylamine, 2-adamantyl-N-methyl-, hydrochloride, 2-(1-adamantyl)-N-methylethanamine, [2-(1-Adamantyl)ethyl]methylamine HCl
| Molecular Formula | C13H24ClN |
|---|---|
| Molecular Weight | 229.16 g/mol |
| LogP | 3.23 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.15973 |
| Heavy Atoms | 15 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 31897-97-9 |
|---|---|
| SMILES | CNCCC12CC3CC(C1)CC(C3)C2.Cl |
| InChIKey | PVMRHHYSMYVGQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Adamantane, 1-(2-methylaminoethyl)-, hydrochloride (CAS 31897-97-9), with molecular formula C13H24ClN and molecular weight 229.16 g/mol. IUPAC: 2-(1-adamantyl)-N-methylethanamine;hydrochloride.
Chemical Property Profile of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride
Property Insights of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride
The XLogP value of 3.23 indicates that Adamantane, 1-(2-methylaminoethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Adamantane, 1-(2-methylaminoethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Adamantane, 1-(2-methylaminoethyl)-, hydrochloride has 2 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 Adamantane, 1-(2-methylaminoethyl)-, hydrochloride?
The CAS number of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride is 31897-97-9.
What is the molecular formula of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride?
The molecular formula of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride is C13H24ClN.
What is the molecular weight of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride?
The molecular weight of Adamantane, 1-(2-methylaminoethyl)-, hydrochloride is 229.16 g/mol.
Where can I buy Adamantane, 1-(2-methylaminoethyl)-, hydrochloride?
You can request a quote for Adamantane, 1-(2-methylaminoethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adamantane, 1-(2-methylaminoethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Adamantane, 1-(2-methylaminoethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.