TL;DR: N-Allylphthalimide (CAS 10196-18-6) is a chemical compound with molecular formula C11H9NO2 and molecular weight 187.06332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-prop-2-enylisoindole-1,3-dione
Also Known As: N-Allylphthalimide, 2-Allylisoindoline-1,3-dione, N-Allylphthalimid, N-(2-Propenyl)phthalimide, N-allyl-phthalimide
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H9NO2 |
| Molecular Weight | 187.06332 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.06332 Da |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
| SMILES | C=CCN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | MHHGQWMCVNQHLG-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Allylphthalimide. With a topological polar surface area (TPSA) of 37.4 Ų, N-Allylphthalimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Allylphthalimide 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 N-Allylphthalimide is 10196-18-6.
The molecular formula of N-Allylphthalimide is C11H9NO2.
The molecular weight of N-Allylphthalimide is 187.06332 g/mol.
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