TL;DR: 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- (CAS 101602-45-3) is a chemical compound with molecular formula C17H22N2 and molecular weight 254.1783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-3-(2-methyl-4-pyridinyl)-3-phenylpropan-1-amine
Also Known As: 4-(alpha-(2-(Dimethylamino)ethyl)benzyl)-2-picoline, 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)-, N,N-dimethyl-3-(2-methylpyridin-4-yl)-3-phenylpropan-1-amine, Pyridine, 2-methyl-4-(alpha-(2-(dimethylamino)ethyl)benzyl)-, 3',5'-dibromo-2'-hydroxy-3,4-dimethoxy-trans-chalcone
| Molecular Formula | C17H22N2 |
| Molecular Weight | 254.1783 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 16.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 254.1783 Da |
| Heavy Atoms | 19 |
| Complexity | 246.0 |
| SMILES | CC1=NC=CC(=C1)C(CCN(C)C)C2=CC=CC=C2 |
| InChIKey | NLCGTKYPPXDCRX-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.1 Ų, 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- has 0 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-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- is 101602-45-3.
The molecular formula of 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- is C17H22N2.
The molecular weight of 2-Picoline, 4-(alpha-(2-(dimethylamino)ethyl)benzyl)- is 254.1783 g/mol.
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