TL;DR: 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine (CAS 126318-00-1) is a chemical compound with molecular formula C16H25NO and molecular weight 247.19362 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-benzyl-2,2-dimethyloxan-4-yl)ethanamine
Also Known As: TimTec1_008125, 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine, 1-Pentafluorophenyl-2-thiourea, 2-(4-benzyl-2,2-dimethyloxan-4-yl)ethanamine, 3376AD
| Molecular Formula | C16H25NO |
| Molecular Weight | 247.19362 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.19362 Da |
| Heavy Atoms | 18 |
| Complexity | 258.0 |
| SMILES | CC1(CC(CCO1)(CCN)CC2=CC=CC=C2)C |
| InChIKey | PIEDATHHFQLXTM-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine. With a topological polar surface area (TPSA) of 35.3 Ų, 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine has 1 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 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine is 126318-00-1.
The molecular formula of 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine is C16H25NO.
The molecular weight of 2-(4-Benzyl-2,2-dimethyl-tetrahydro-pyran-4-yl)-ethylamine is 247.19362 g/mol.
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