6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol

C17H11F3O2 — CID 122191867

IUPAC6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol
SMILESOc1ccc2cc(-c3ccc(O)c(C(F)(F)F)c3)ccc2c1
InChIInChI=1S/C17H11F3O2/c18-17(19,20)15-9-13(4-6-16(15)22)10-1-2-12-8-14(21)5-3-11(12)7-10/h1-9,21-22H
InChIKeyFYZAEHFMTZMQIM-UHFFFAOYSA-N
MW304.27 g/mol
LogP4.94
Rot. Bonds1

About 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol

6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol (PubChem CID 122191867) has the molecular formula C17H11F3O2 and a molecular weight of 304.27 g/mol. Its IUPAC name is 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol.

Molecular Properties

Compound Name6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol
PubChem CID122191867
Molecular FormulaC17H11F3O2
Molecular Weight304.27 g/mol
Exact Mass304.07
IUPAC Name6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol
SMILESOc1ccc2cc(-c3ccc(O)c(C(F)(F)F)c3)ccc2c1
InChIInChI=1S/C17H11F3O2/c18-17(19,20)15-9-13(4-6-16(15)22)10-1-2-12-8-14(21)5-3-11(12)7-10/h1-9,21-22H
InChIKeyFYZAEHFMTZMQIM-UHFFFAOYSA-N
XLogP4.94
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.27
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol?
The IUPAC name of 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol (CID 122191867) is 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol.
What is the SMILES notation for 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol?
The canonical SMILES for 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol is Oc1ccc2cc(-c3ccc(O)c(C(F)(F)F)c3)ccc2c1.
What is the InChIKey of 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol?
The InChIKey is FYZAEHFMTZMQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3O2/c18-17(19,20)15-9-13(4-6-16(15)22)10-1-2-12-8-14(21)5-3-11(12)7-10/h1-9,21-22H.
What are the key properties of 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol?
6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol has a molecular weight of 304.27 g/mol, XLogP of 4.94, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-hydroxy-3-(trifluoromethyl)phenyl]naphthalen-2-ol is sourced from PubChem (CID 122191867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).