TL;DR: 1,3-Benzodioxol-5-yl-1-piperidinylmethanone (CAS 34023-62-6) is a chemical compound with molecular formula C13H15NO3 and molecular weight 233.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-benzodioxol-5-yl(piperidin-1-yl)methanone
Also Known As: 1-BCP, Piperonylic acid piperidide, 1-(1,3-Benzodioxol-5-ylcarbonyl)piperidine, PIPERONYLIC ACID, 1,3-BYCP
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H15NO3 |
| Molecular Weight | 233.1052 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.1052 Da |
| Heavy Atoms | 17 |
| Complexity | 288.0 |
| SMILES | C1CCN(CC1)C(=O)C2=CC3=C(C=C2)OCO3 |
| InChIKey | BXBNADAPIHHXJQ-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzodioxol-5-yl-1-piperidinylmethanone. With a topological polar surface area (TPSA) of 38.8 Ų, 1,3-Benzodioxol-5-yl-1-piperidinylmethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxol-5-yl-1-piperidinylmethanone has 0 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 1,3-Benzodioxol-5-yl-1-piperidinylmethanone is 34023-62-6.
The molecular formula of 1,3-Benzodioxol-5-yl-1-piperidinylmethanone is C13H15NO3.
The molecular weight of 1,3-Benzodioxol-5-yl-1-piperidinylmethanone is 233.1052 g/mol.
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