TL;DR: 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)- (CAS 141542-60-1) is a chemical compound with molecular formula C14H15FN2O2 and molecular weight 262.11176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-fluoro-1-(piperidin-1-ylmethyl)indole-2,3-dione
Also Known As: 3-amino-3-morpholinoacrylonitrile, 6-Fluoro-1-(piperidin-1-ylmethyl)indoline-2,3-dione, 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)-, 6-fluoro-1-(piperidin-1-ylmethyl)indole-2,3-dione, 6-fluoro-1-(1-piperidylmethyl)indole-2,3-dione
| Molecular Formula | C14H15FN2O2 |
| Molecular Weight | 262.11176 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.11176 Da |
| Heavy Atoms | 19 |
| Complexity | 382.0 |
| SMILES | C1CCN(CC1)CN2C3=C(C=CC(=C3)F)C(=O)C2=O |
| InChIKey | AURNGYUHECPHGA-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)-. With a topological polar surface area (TPSA) of 40.6 Ų, 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)- 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 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)- is 141542-60-1.
The molecular formula of 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)- is C14H15FN2O2.
The molecular weight of 1H-Indole-2,3-dione, 6-fluoro-1-(1-piperidinylmethyl)- is 262.11176 g/mol.
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