About 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol
4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492875) has the molecular formula C19H12F3NO
and a molecular weight of 327.31 g/mol. Its IUPAC name is 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol.
Molecular Properties
| Compound Name | 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol |
| PubChem CID | 59492875 |
| Molecular Formula | C19H12F3NO |
| Molecular Weight | 327.31 g/mol |
| Exact Mass | 327.09 |
| IUPAC Name | 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol |
| SMILES | OC1(C(F)(F)F)c2ccccc2-c2c(-c3cccnc3)cccc21 |
| InChI | InChI=1S/C19H12F3NO/c20-19(21,22)18(24)15-8-2-1-6-14(15)17-13(7-3-9-16(17)18)12-5-4-10-23-11-12/h1-11,24H |
| InChIKey | QFNIHBFXNCTFCH-UHFFFAOYSA-N |
| XLogP | 4.53 |
| TPSA | 33.12 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 327.31 |
| LogP ≤ 5 | 4.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol (CID 59492875) is 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol is OC1(C(F)(F)F)c2ccccc2-c2c(-c3cccnc3)cccc21.
What is the InChIKey of 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is QFNIHBFXNCTFCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3NO/c20-19(21,22)18(24)15-8-2-1-6-14(15)17-13(7-3-9-16(17)18)12-5-4-10-23-11-12/h1-11,24H.
What are the key properties of 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol?
4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 327.31 g/mol, XLogP of 4.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-yl-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).