2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol

C20H14F3NO — CID 59492518

IUPAC2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol
SMILESCc1cc(-c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)ccn1
InChIInChI=1S/C20H14F3NO/c1-12-10-14(8-9-24-12)13-6-7-16-15-4-2-3-5-17(15)19(25,18(16)11-13)20(21,22)23/h2-11,25H,1H3
InChIKeyVLCDCADMDOXNQW-UHFFFAOYSA-N
MW341.33 g/mol
LogP4.84
Rot. Bonds1

About 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol

2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492518) has the molecular formula C20H14F3NO and a molecular weight of 341.33 g/mol. Its IUPAC name is 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492518
Molecular FormulaC20H14F3NO
Molecular Weight341.33 g/mol
Exact Mass341.10
IUPAC Name2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol
SMILESCc1cc(-c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)ccn1
InChIInChI=1S/C20H14F3NO/c1-12-10-14(8-9-24-12)13-6-7-16-15-4-2-3-5-17(15)19(25,18(16)11-13)20(21,22)23/h2-11,25H,1H3
InChIKeyVLCDCADMDOXNQW-UHFFFAOYSA-N
XLogP4.84
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.33
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol (CID 59492518) is 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol is Cc1cc(-c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)ccn1.
What is the InChIKey of 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is VLCDCADMDOXNQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3NO/c1-12-10-14(8-9-24-12)13-6-7-16-15-4-2-3-5-17(15)19(25,18(16)11-13)20(21,22)23/h2-11,25H,1H3.
What are the key properties of 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol?
2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 341.33 g/mol, XLogP of 4.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-4-pyridinyl)-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).