About (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol
(Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol (PubChem CID 136815132) has the molecular formula C14H10F3NO
and a molecular weight of 265.23 g/mol. Its IUPAC name is (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol.
Molecular Properties
| Compound Name | (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol |
| PubChem CID | 136815132 |
| Molecular Formula | C14H10F3NO |
| Molecular Weight | 265.23 g/mol |
| Exact Mass | 265.07 |
| IUPAC Name | (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol |
| SMILES | O/C(=C\c1ccccn1)c1ccc(C(F)(F)F)cc1 |
| InChI | InChI=1S/C14H10F3NO/c15-14(16,17)11-6-4-10(5-7-11)13(19)9-12-3-1-2-8-18-12/h1-9,19H/b13-9- |
| InChIKey | XBTKYERQHVXLLG-LCYFTJDESA-N |
| XLogP | 4.16 |
| TPSA | 33.12 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 265.23 |
| LogP ≤ 5 | 4.16 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol?
The IUPAC name of (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol (CID 136815132) is (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol.
What is the SMILES notation for (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol?
The canonical SMILES for (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol is O/C(=C\c1ccccn1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol?
The InChIKey is XBTKYERQHVXLLG-LCYFTJDESA-N. The full InChI is InChI=1S/C14H10F3NO/c15-14(16,17)11-6-4-10(5-7-11)13(19)9-12-3-1-2-8-18-12/h1-9,19H/b13-9-.
What are the key properties of (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol?
(Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol has a molecular weight of 265.23 g/mol, XLogP of 4.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-pyridin-2-yl-1-[4-(trifluoromethyl)phenyl]ethenol is sourced from PubChem (CID 136815132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).