TL;DR: 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione (CAS 1009575-03-4) is a chemical compound with molecular formula C22H28N2O2 and molecular weight 352.2151 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1-adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione
Also Known As: 3-(1-adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione, VU0507554-1, 3-[(adamantan-1-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-dione, F3019-0030, 3-(adamantanylamino)-1-(4-ethylphenyl)azolidine-2,5-dione
| Molecular Formula | C22H28N2O2 |
| Molecular Weight | 352.2151 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.2151 Da |
| Heavy Atoms | 26 |
| Complexity | 552.0 |
| SMILES | CCC1=CC=C(C=C1)N2C(=O)CC(C2=O)NC34CC5CC(C3)CC(C5)C4 |
| InChIKey | FJJIDOVISDKJDD-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione has 1 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 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione is 1009575-03-4.
The molecular formula of 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione is C22H28N2O2.
The molecular weight of 3-(1-Adamantylamino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione is 352.2151 g/mol.
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