Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride
TL;DR: Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride (CAS 101831-87-2) is a chemical compound with molecular formula C12H17ClN2 and molecular weight 224.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-ethyl-1H-indol-5-yl)-dimethylazanium chloride
Also Known As: 5-Dimethylamino-3-ethylindole hydrochloride, INDOLE, 5-(DIMETHYLAMINO)-3-ETHYL-, HYDROCHLORIDE, (3-ethyl-1H-indol-5-yl)-dimethylazanium chloride, 3-ethyl-n,n-dimethyl-1h-indol-5-aminium chloride, RefChem:1087342
| Molecular Formula | C12H17ClN2 |
|---|---|
| Molecular Weight | 224.11 g/mol |
| LogP | -1.49 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.10803 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 101831-87-2 |
|---|---|
| SMILES | CCC1=CNC2=C1C=C(C=C2)[NH+](C)C.[Cl-] |
| InChIKey | XQCBKTXALMHVEM-UHFFFAOYSA-N |
Product Overview
Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride (CAS 101831-87-2), with molecular formula C12H17ClN2 and molecular weight 224.11 g/mol. IUPAC: (3-ethyl-1H-indol-5-yl)-dimethylazanium chloride.
Chemical Property Profile of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride
Property Insights of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride
The XLogP value of -1.49 indicates that Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.2 Ų, Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 5-(dimethylamino)-3-ethyl-, 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 Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride?
The CAS number of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride is 101831-87-2.
What is the molecular formula of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride?
The molecular formula of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride is C12H17ClN2.
What is the molecular weight of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride?
The molecular weight of Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride is 224.11 g/mol.
Where can I buy Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride?
You can request a quote for Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Indole, 5-(dimethylamino)-3-ethyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.