TL;DR: 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride (CAS 63938-59-0) is a chemical compound with molecular formula C13H17ClN2 and molecular weight 236.10803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-3-pyrrolidin-1-ium-2-ylindole chloride
Also Known As: 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride, INDOLE, 1-METHYL-3-(2-PYRROLIDINYL)-, HYDROCHLORIDE, 1-methyl-3-pyrrolidin-1-ium-2-ylindole chloride, 1H-Indole, 1-methyl-3-(2-pyrrolidinyl)-, monohydrochloride
| Molecular Formula | C13H17ClN2 |
| Molecular Weight | 236.10803 g/mol |
| XLogP | -1.42 |
| Topological Polar Surface Area (TPSA) | 21.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.10803 Da |
| Heavy Atoms | 16 |
| Complexity | 229.0 |
| SMILES | CN1C=C(C2=CC=CC=C21)C3CCC[NH2+]3.[Cl-] |
| InChIKey | NHALRSQXOLZIPN-UHFFFAOYSA-N |
The XLogP value of -1.42 indicates that 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.5 Ų, 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride is 63938-59-0.
The molecular formula of 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride is C13H17ClN2.
The molecular weight of 1-Methyl-3-(2-pyrrolidinyl)indole hydrochloride is 236.10803 g/mol.
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