5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine
TL;DR: 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine (CAS 833-05-6) is a chemical compound with molecular formula C12H15ClN2 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-1H-indol-3-yl)-2-methylpropan-2-amine
Also Known As: 1-(5-chloro-1H-indol-3-yl)-2-methylpropan-2-amine, 5-Chloro-alpha,alpha-dimethyltryptamine, INDOLE, 3-(2-AMINO-2-METHYLPROPYL)-5-CHLORO-, 5-22-10-00184 (Beilstein Handbook Reference), 5-Chloro-
| Molecular Formula | C12H15ClN2 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.09238 |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 833-05-6 |
|---|---|
| SMILES | CC(C)(CC1=CNC2=C1C=C(C=C2)Cl)N |
| InChIKey | QRNZKEMEJDHWLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine (CAS 833-05-6), with molecular formula C12H15ClN2 and molecular weight 222.09 g/mol. IUPAC: 1-(5-chloro-1H-indol-3-yl)-2-methylpropan-2-amine.
Chemical Property Profile of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine
Property Insights of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine. With a topological polar surface area (TPSA) of 41.8 Ų, 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine 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 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine?
The CAS number of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine is 833-05-6.
What is the molecular formula of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine?
The molecular formula of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine is C12H15ClN2.
What is the molecular weight of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine?
The molecular weight of 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine is 222.09 g/mol.
Where can I buy 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine?
You can request a quote for 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-alpha,alpha-dimethyl-1H-indole-3-ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.