TL;DR: 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine (CAS 6628-90-6) is a chemical compound with molecular formula C14H26N2 and molecular weight 222.2096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-6-pyrrolidin-1-ylhex-4-yn-1-amine
Also Known As: 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine, 6-Diethylamino-1-pyrrolidino-2-hexyne, 1-(6-(Diethylamino)-2-hexynyl)pyrrolidine, 1-[6- -2-hexynyl]pyrrolidine, Pyrrolidine, 1-(6-(diethylamino)-2-hexynyl)-
| Molecular Formula | C14H26N2 |
| Molecular Weight | 222.2096 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 222.2096 Da |
| Heavy Atoms | 16 |
| Complexity | 226.0 |
| SMILES | CCN(CC)CCCC#CCN1CCCC1 |
| InChIKey | QOCRDZQDEHRKSS-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine. With a topological polar surface area (TPSA) of 6.5 Ų, 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine 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 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine is 6628-90-6.
The molecular formula of 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine is C14H26N2.
The molecular weight of 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine is 222.2096 g/mol.
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