TL;DR: (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide (CAS 1615697-42-1) is a chemical compound with molecular formula C15H11FN2O3 and molecular weight 286.07538 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide
Also Known As: (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide, BAS 00168047, BIM-0015252.P001, (2E)-N-(3-Fluorophenyl)-3-(3-nitrophenyl)-2-propenamide, N-(3-fluorophenyl)-3-(3-nitrophenyl)acrylamide
| Molecular Formula | C15H11FN2O3 |
| Molecular Weight | 286.07538 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.07538 Da |
| Heavy Atoms | 21 |
| Complexity | 408.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NC2=CC(=CC=C2)F |
| InChIKey | LXBQHJMCULDZRR-BQYQJAHWSA-N |
The XLogP value of 3.1 indicates that (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide. Following Lipinski's Rule of Five, (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide is 1615697-42-1.
The molecular formula of (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide is C15H11FN2O3.
The molecular weight of (2E)-N-(3-fluorophenyl)-3-(3-nitrophenyl)prop-2-enamide is 286.07538 g/mol.
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