TL;DR: 2-{[6-(Benzylamino)hexyl]amino}ethanol (CAS 116822-39-0) is a chemical compound with molecular formula C15H26N2O and molecular weight 250.20451 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[6-(benzylamino)hexylamino]ethanol
Also Known As: 2-[6-(benzylamino)hexylamino]ethanol, 2-{[6-(benzylamino)hexyl]amino}ethanol, 2-({6-[benzylamino]hexyl}amino)ethan-1-ol, AQ-387/42302706
| Molecular Formula | C15H26N2O |
| Molecular Weight | 250.20451 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 44.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 250.20451 Da |
| Heavy Atoms | 18 |
| Complexity | 170.0 |
| SMILES | C1=CC=C(C=C1)CNCCCCCCNCCO |
| InChIKey | YNJBQDNTRABNCU-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[6-(Benzylamino)hexyl]amino}ethanol. With a topological polar surface area (TPSA) of 44.3 Ų, 2-{[6-(Benzylamino)hexyl]amino}ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[6-(Benzylamino)hexyl]amino}ethanol has 3 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 2-{[6-(Benzylamino)hexyl]amino}ethanol is 116822-39-0.
The molecular formula of 2-{[6-(Benzylamino)hexyl]amino}ethanol is C15H26N2O.
The molecular weight of 2-{[6-(Benzylamino)hexyl]amino}ethanol is 250.20451 g/mol.
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