TL;DR: 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane (CAS 155868-52-3) is a chemical compound with molecular formula C14H18FNO2 and molecular weight 251.13216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-[(3-fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
Also Known As: 8-[(3-fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane, 8-(3-fluorobenzyl)-1,4-dioxa-8-azaspiro[4.5]decane
| Molecular Formula | C14H18FNO2 |
| Molecular Weight | 251.13216 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.13216 Da |
| Heavy Atoms | 18 |
| Complexity | 271.0 |
| SMILES | C1CN(CCC12OCCO2)CC3=CC(=CC=C3)F |
| InChIKey | MCWPOEPNYMCVLP-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane. With a topological polar surface area (TPSA) of 21.7 Ų, 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane 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 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is 155868-52-3.
The molecular formula of 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is C14H18FNO2.
The molecular weight of 8-[(3-Fluorophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is 251.13216 g/mol.
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