TL;DR: 5-Fluoro-2-(pyrrolidin-1-yl)aniline (CAS 1431966-86-7) is a chemical compound with molecular formula C10H13FN2 and molecular weight 180.10628 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-fluoro-2-pyrrolidin-1-ylaniline
Also Known As: 5-fluoro-2-(pyrrolidin-1-yl)aniline, 5-fluoro-2-pyrrolidin-1-ylaniline, 5-Fluoro-2-(1-pyrrolidinyl)aniline, 5-Fluoro-2-pyrrolidin-1-yl-phenylamine, 5-fluoro-2-pyrrolidinylphenylamine
| Molecular Formula | C10H13FN2 |
| Molecular Weight | 180.10628 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 29.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.10628 Da |
| Heavy Atoms | 13 |
| Complexity | 168.0 |
| SMILES | C1CCN(C1)C2=C(C=C(C=C2)F)N |
| InChIKey | OLTNXVUFYDGSSG-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoro-2-(pyrrolidin-1-yl)aniline. With a topological polar surface area (TPSA) of 29.3 Ų, 5-Fluoro-2-(pyrrolidin-1-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoro-2-(pyrrolidin-1-yl)aniline 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 5-Fluoro-2-(pyrrolidin-1-yl)aniline is 1431966-86-7.
The molecular formula of 5-Fluoro-2-(pyrrolidin-1-yl)aniline is C10H13FN2.
The molecular weight of 5-Fluoro-2-(pyrrolidin-1-yl)aniline is 180.10628 g/mol.
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