About 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 110696997) has the molecular formula C14H11F3N2O
and a molecular weight of 280.25 g/mol. Its IUPAC name is 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide.
Molecular Properties
| Compound Name | 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide |
| PubChem CID | 110696997 |
| Molecular Formula | C14H11F3N2O |
| Molecular Weight | 280.25 g/mol |
| Exact Mass | 280.08 |
| IUPAC Name | 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide |
| SMILES | O=C(Cc1ccccn1)Nc1ccccc1C(F)(F)F |
| InChI | InChI=1S/C14H11F3N2O/c15-14(16,17)11-6-1-2-7-12(11)19-13(20)9-10-5-3-4-8-18-10/h1-8H,9H2,(H,19,20) |
| InChIKey | MLFRTTSXHIMPQU-UHFFFAOYSA-N |
| XLogP | 3.28 |
| TPSA | 41.99 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.25 |
| LogP ≤ 5 | 3.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide (CID 110696997) is 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide is O=C(Cc1ccccn1)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is MLFRTTSXHIMPQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O/c15-14(16,17)11-6-1-2-7-12(11)19-13(20)9-10-5-3-4-8-18-10/h1-8H,9H2,(H,19,20).
What are the key properties of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 280.25 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 110696997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).