TL;DR: 5-Phenyl-2,4-pentadien-1-amine (CAS 165735-96-6) is a chemical compound with molecular formula C11H13N and molecular weight 159.1048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-phenylpenta-2,4-dien-1-amine
Also Known As: 5-phenylpenta-2,4-dien-1-amine, 5-Phenyl-2,4-pentadien-1-amine
| Molecular Formula | C11H13N |
| Molecular Weight | 159.1048 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 159.1048 Da |
| Heavy Atoms | 12 |
| Complexity | 152.0 |
| SMILES | C1=CC=C(C=C1)C=CC=CCN |
| InChIKey | ZEFASBSUMFMCOK-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenyl-2,4-pentadien-1-amine. With a topological polar surface area (TPSA) of 26.0 Ų, 5-Phenyl-2,4-pentadien-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyl-2,4-pentadien-1-amine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-Phenyl-2,4-pentadien-1-amine is 165735-96-6.
The molecular formula of 5-Phenyl-2,4-pentadien-1-amine is C11H13N.
The molecular weight of 5-Phenyl-2,4-pentadien-1-amine is 159.1048 g/mol.
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