TL;DR: 4-(Pyrimidin-2-yloxy)aniline (CAS 105130-26-5) is a chemical compound with molecular formula C10H9N3O and molecular weight 187.07455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-pyrimidin-2-yloxyaniline
Also Known As: 4-(2-pyrimidinyloxy)aniline, 4-pyrimidin-2-yloxyaniline, 4-(pyrimidin-2-yloxy)aniline, 4-(pyrimidin-2-yloxy)phenylamine, 4-(Pyrimidin-2-yloxy)benzenamine
| Molecular Formula | C10H9N3O |
| Molecular Weight | 187.07455 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.07455 Da |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
| SMILES | C1=CN=C(N=C1)OC2=CC=C(C=C2)N |
| InChIKey | OYPOTUTZLSXURN-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Pyrimidin-2-yloxy)aniline. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Pyrimidin-2-yloxy)aniline. Following Lipinski's Rule of Five, 4-(Pyrimidin-2-yloxy)aniline 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 4-(Pyrimidin-2-yloxy)aniline is 105130-26-5.
The molecular formula of 4-(Pyrimidin-2-yloxy)aniline is C10H9N3O.
The molecular weight of 4-(Pyrimidin-2-yloxy)aniline is 187.07455 g/mol.
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