TL;DR: 4-[1-(Phenylethynyl)cyclopentyl]morpholine (CAS 164264-98-6) is a chemical compound with molecular formula C17H21NO and molecular weight 255.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[1-(2-phenylethynyl)cyclopentyl]morpholine
Also Known As: 4-[1-(phenylethynyl)cyclopentyl]morpholine, 4-[1-(2-phenylethynyl)cyclopentyl]morpholine, 4-(1-(Phenylethynyl)cyclopentyl)morpholine, Morpholine, 4-[1-(phenylethynyl)cyclopentyl]-, 1-morpholino-1-(phenylethynyl)cyclopentane
| Molecular Formula | C17H21NO |
| Molecular Weight | 255.16231 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.16231 Da |
| Heavy Atoms | 19 |
| Complexity | 346.0 |
| SMILES | C1CCC(C1)(C#CC2=CC=CC=C2)N3CCOCC3 |
| InChIKey | VYDQOKHJRQEQEZ-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[1-(Phenylethynyl)cyclopentyl]morpholine. With a topological polar surface area (TPSA) of 12.5 Ų, 4-[1-(Phenylethynyl)cyclopentyl]morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[1-(Phenylethynyl)cyclopentyl]morpholine 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 4-[1-(Phenylethynyl)cyclopentyl]morpholine is 164264-98-6.
The molecular formula of 4-[1-(Phenylethynyl)cyclopentyl]morpholine is C17H21NO.
The molecular weight of 4-[1-(Phenylethynyl)cyclopentyl]morpholine is 255.16231 g/mol.
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