TL;DR: Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)- (CAS 108621-85-8) is a chemical compound with molecular formula C14H24N2O and molecular weight 236.18886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-aminophenyl)-2-[methyl(pentyl)amino]ethanol
Also Known As: alpha-(m-Aminophenyl)-beta-methylpentylaminoethanol, 1-(3-aminophenyl)-2-[methyl(pentyl)amino]ethanol, m-Amino-alpha-((methylpentylamino)methyl)benzyl alcohol, 1-(3-aminophenyl)-2-(methyl-pentylamino)ethanol, BENZYL ALCOHOL, m-AMINO-alpha-((METHYLPENTYLAMINO)METHYL)-
| Molecular Formula | C14H24N2O |
| Molecular Weight | 236.18886 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 49.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.18886 Da |
| Heavy Atoms | 17 |
| Complexity | 199.0 |
| SMILES | CCCCCN(C)CC(C1=CC(=CC=C1)N)O |
| InChIKey | MXUBNUMMIHAQBF-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)-. With a topological polar surface area (TPSA) of 49.5 Ų, Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)- has 2 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 Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)- is 108621-85-8.
The molecular formula of Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)- is C14H24N2O.
The molecular weight of Benzyl alcohol, m-amino-alpha-((methylpentylamino)methyl)- is 236.18886 g/mol.
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