TL;DR: 2-(1-Piperazinylmethyl)quinoline (CAS 118630-28-7) is a chemical compound with molecular formula C14H17N3 and molecular weight 227.14224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(piperazin-1-ylmethyl)quinoline
Also Known As: 2-(piperazin-1-ylmethyl)quinoline, starbld0046654, 2-[(Piperazin-1-yl)methyl]quinoline, 2-piperazin-1-ylmethyl-quinoline, 2-(1-piperazinylmethyl)quinoline
| Molecular Formula | C14H17N3 |
| Molecular Weight | 227.14224 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.14224 Da |
| Heavy Atoms | 17 |
| Complexity | 238.0 |
| SMILES | C1CN(CCN1)CC2=NC3=CC=CC=C3C=C2 |
| InChIKey | VKUOCFNMBIBWEY-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Piperazinylmethyl)quinoline. With a topological polar surface area (TPSA) of 28.2 Ų, 2-(1-Piperazinylmethyl)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Piperazinylmethyl)quinoline has 1 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-(1-Piperazinylmethyl)quinoline is 118630-28-7.
The molecular formula of 2-(1-Piperazinylmethyl)quinoline is C14H17N3.
The molecular weight of 2-(1-Piperazinylmethyl)quinoline is 227.14224 g/mol.
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