TL;DR: 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine] (CAS 147817-37-6) is a chemical compound with molecular formula C15H21NO and molecular weight 231.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1'-propylspiro[1H-2-benzofuran-3,4'-piperidine]
Also Known As: 1'-propyl-3H-spiro[2-benzofuran-1,4'-piperidine], 1'-propylspiro[1H-isobenzofuran-3,4'-piperidine], 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine], 1-Propylspiro[piperidine-4,1 (3 H)-isobenzofuran]
| Molecular Formula | C15H21NO |
| Molecular Weight | 231.16231 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.16231 Da |
| Heavy Atoms | 17 |
| Complexity | 258.0 |
| SMILES | CCCN1CCC2(CC1)C3=CC=CC=C3CO2 |
| InChIKey | VECWJSYHBNBEBX-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine]. With a topological polar surface area (TPSA) of 12.5 Ų, 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine] has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine] is 147817-37-6.
The molecular formula of 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine] is C15H21NO.
The molecular weight of 1''-propyl-3H-spiro[2-benzofuran-1,4''-piperidine] is 231.16231 g/mol.
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