TL;DR: Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride (CAS 120144-93-6) is a chemical compound with molecular formula C12H21Cl2N3 and molecular weight 277.11127 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(6-propan-2-yl-2-pyridinyl)piperazine;dihydrochloride
Also Known As: 1-(6-(1-Methylethyl)-2-pyridinyl)piperazine dihydrochloride, Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride, 1-(6-propan-2-ylpyridin-2-yl)piperazine dihydrochloride, 1-(6-propan-2-ylpyridin-2-yl)piperazine,dihydrochloride, 1-[6-(Propan-2-yl)pyridin-2-yl]piperazine--hydrogen chloride (1/2)
| Molecular Formula | C12H21Cl2N3 |
| Molecular Weight | 277.11127 g/mol |
| XLogP | 2.4582 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.11127 Da |
| Heavy Atoms | 17 |
| Complexity | 187.0 |
| SMILES | CC(C)C1=NC(=CC=C1)N2CCNCC2.Cl.Cl |
| InChIKey | ADCPCOCCADMHBU-UHFFFAOYSA-N |
The XLogP value of 2.4582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride. With a topological polar surface area (TPSA) of 28.2 Ų, Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride 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 Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride is 120144-93-6.
The molecular formula of Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride is C12H21Cl2N3.
The molecular weight of Piperazine, 1-(6-(1-methylethyl)-2-pyridinyl)-, dihydrochloride is 277.11127 g/mol.
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