TL;DR: 2-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl- (CAS 111980-47-3) is a chemical compound with molecular formula C15H23N3 and molecular weight 245.1892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-3-(2-methyl-5-phenyl-4,5-dihydroimidazol-1-yl)propan-1-amine
Also Known As: TT-61-82, 1-(3-(Dimethylamino)propyl)-2-methyl-5-phenyl-2-imidazoline, 1-(3-Dimetyloaminopropylo)-2-metylo-5-fenyloimidazolina, 2-IMIDAZOLINE, 1-(3-(DIMETHYLAMINO)PROPYL)-2-METHYL-5-PHENYL-, 1-(3-Dimetyloaminopropylo)-2-metylo-5-fenyloimidazolina [Polish]
| Molecular Formula | C15H23N3 |
| Molecular Weight | 245.1892 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 18.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.1892 Da |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
| SMILES | CC1=NCC(N1CCCN(C)C)C2=CC=CC=C2 |
| InChIKey | YDWBUOWTVMNDLQ-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl-. With a topological polar surface area (TPSA) of 18.8 Ų, 2-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl- 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-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl- is 111980-47-3.
The molecular formula of 2-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl- is C15H23N3.
The molecular weight of 2-Imidazoline, 1-(3-(dimethylamino)propyl)-2-methyl-5-phenyl- is 245.1892 g/mol.
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