TL;DR: 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one (CAS 585558-16-3) is a chemical compound with molecular formula C17H22N2O3 and molecular weight 302.16306 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indole]-2'-one
Also Known As: 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one, 1'-((4-methylpiperidin-1-yl)methyl)spiro[[1,3]dioxolane-2,3'-indolin]-2'-one, 1'-[(4-methyl-1-piperidyl)methyl]spiro[1,3-dioxolane-2,3'-indole]-2'-one, 1'-[(4-METHYLPIPERIDIN-1-YL)METHYL]SPIRO[1,3-DIOXOLANE-2,3'-INDOL]-2'-ONE, 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indole]-2'-one
| Molecular Formula | C17H22N2O3 |
| Molecular Weight | 302.16306 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.16306 Da |
| Heavy Atoms | 22 |
| Complexity | 428.0 |
| SMILES | CC1CCN(CC1)CN2C3=CC=CC=C3C4(C2=O)OCCO4 |
| InChIKey | GYXZCJUGAHWTRR-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one. With a topological polar surface area (TPSA) of 42.0 Ų, 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is 585558-16-3.
The molecular formula of 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is C17H22N2O3.
The molecular weight of 1'-[(4-methylpiperidin-1-yl)methyl]spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is 302.16306 g/mol.
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