2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)
TL;DR: 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) (CAS 52582-98-6) is a chemical compound with molecular formula C13H23Cl2N and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloro-1-adamantyl)-N-methylethanamine;hydrochloride
Also Known As: 1-Adamantaneethylamine, 2-chloro-N-methyl-, hydrochloride, 2-Chloro-N-methyl-1-adamantaneethanamine hydrochloride, 2-(2-chloro-1-adamantyl)-N-methylethanamine hydrochloride, Ethylamine, 2-(2-chloro-1-adamantyl)-N-methyl-, hydrochloride, ADAMANTANE, 2-CHLORO-1-(2-(METHYLAMINO)ETHYL)-, HYDROCHLORIDE
| Molecular Formula | C13H23Cl2N |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 3.45 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.12076 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 52582-98-6 |
|---|---|
| SMILES | CNCCC12CC3CC(C1)CC(C3)C2Cl.Cl |
| InChIKey | BJVUKUWSDFUNPA-UHFFFAOYSA-N |
Product Overview
2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) (CAS 52582-98-6), with molecular formula C13H23Cl2N and molecular weight 263.12 g/mol. IUPAC: 2-(2-chloro-1-adamantyl)-N-methylethanamine;hydrochloride.
Chemical Property Profile of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)
Property Insights of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)
The XLogP value of 3.45 indicates that 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) 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 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)?
The CAS number of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) is 52582-98-6.
What is the molecular formula of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)?
The molecular formula of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) is C13H23Cl2N.
What is the molecular weight of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)?
The molecular weight of 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) is 263.12 g/mol.
Where can I buy 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)?
You can request a quote for 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.