TL;DR: Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride (CAS 73826-42-3) is a chemical compound with molecular formula C15H22ClNO2 and molecular weight 283.1339 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-ethoxyphenyl)-3-pyrrolidin-1-ylpropan-1-one;hydrochloride
Also Known As: 4'-Ethoxy-3-pyrrolidinylpropiophenone hydrochloride, Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride, 1-(4-ethoxyphenyl)-3-pyrrolidin-1-ylpropan-1-one hydrochloride, 1-Propanone, 1-(4-ethoxyphenyl)-3-(1-pyrrolidinyl)-, hydrochloride, 1-(4-Ethoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one--hydrogen chloride (1/1)
| Molecular Formula | C15H22ClNO2 |
| Molecular Weight | 283.1339 g/mol |
| XLogP | 3.1757 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.1339 Da |
| Heavy Atoms | 19 |
| Complexity | 253.0 |
| SMILES | CCOC1=CC=C(C=C1)C(=O)CCN2CCCC2.Cl |
| InChIKey | XAKWCEBLVVGJAZ-UHFFFAOYSA-N |
The XLogP value of 3.1757 indicates that Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride has 1 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 Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride is 73826-42-3.
The molecular formula of Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride is C15H22ClNO2.
The molecular weight of Propiophenone, 4'-ethoxy-3-pyrrolidinyl-, hydrochloride is 283.1339 g/mol.
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