TL;DR: 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) (CAS 63906-35-4) is a chemical compound with molecular formula C14H19ClN2O2 and molecular weight 282.1135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(1H-indol-3-yl)acetyl]oxyethyl-dimethylazanium chloride
Also Known As: 2-Dimethylaminoethyl (1H-indol-3-yl)acetate hydrochloride, 2-[2-(1H-indol-3-yl)acetyl]oxyethyl-dimethylazanium chloride, ACETIC ACID, (1H-INDOL-3-YL)-, 2-DIMETHYLAMINOETHYL ESTER, HYDROCHLORIDE, 1H-Indole-3-acetic acid, 2-(dimethylamino)ethyl ester, monohydrochloride, 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1)
| Molecular Formula | C14H19ClN2O2 |
| Molecular Weight | 282.1135 g/mol |
| XLogP | -2.6 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.1135 Da |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
| SMILES | C[NH+](C)CCOC(=O)CC1=CNC2=CC=CC=C21.[Cl-] |
| InChIKey | HEUYKGNOPUJGSK-UHFFFAOYSA-N |
The XLogP value of -2.6 indicates that 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) is 63906-35-4.
The molecular formula of 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) is C14H19ClN2O2.
The molecular weight of 2-(Dimethylamino)ethyl (1H-indol-3-yl)acetate--hydrogen chloride (1/1) is 282.1135 g/mol.
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