TL;DR: 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol (CAS 106220-85-3) is a chemical compound with molecular formula C14H22N2O and molecular weight 234.17322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol
Also Known As: 5-(azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol, 5-[(Azepan-1-yl)methyl]-2,4-dimethylpyridin-3-ol
| Molecular Formula | C14H22N2O |
| Molecular Weight | 234.17322 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 36.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.17322 Da |
| Heavy Atoms | 17 |
| Complexity | 226.0 |
| SMILES | CC1=C(C(=NC=C1CN2CCCCCC2)C)O |
| InChIKey | UTZADGZNWLJHDG-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol. With a topological polar surface area (TPSA) of 36.4 Ų, 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol 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 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol is 106220-85-3.
The molecular formula of 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol is C14H22N2O.
The molecular weight of 5-(Azepan-1-ylmethyl)-2,4-dimethylpyridin-3-ol is 234.17322 g/mol.
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