2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol

C23H15F3N2O — CID 136740466

IUPAC2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol
SMILESOc1ccccc1-c1cc(-c2ccc(C(F)(F)F)cc2)cc(-c2ccccn2)n1
InChIInChI=1S/C23H15F3N2O/c24-23(25,26)17-10-8-15(9-11-17)16-13-20(18-5-1-2-7-22(18)29)28-21(14-16)19-6-3-4-12-27-19/h1-14,29H
InChIKeyHRDNARNQJAOZSF-UHFFFAOYSA-N
MW392.38 g/mol
LogP6.20
Rot. Bonds3

About 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol

2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol (PubChem CID 136740466) has the molecular formula C23H15F3N2O and a molecular weight of 392.38 g/mol. Its IUPAC name is 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol.

Molecular Properties

Compound Name2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol
PubChem CID136740466
Molecular FormulaC23H15F3N2O
Molecular Weight392.38 g/mol
Exact Mass392.11
IUPAC Name2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol
SMILESOc1ccccc1-c1cc(-c2ccc(C(F)(F)F)cc2)cc(-c2ccccn2)n1
InChIInChI=1S/C23H15F3N2O/c24-23(25,26)17-10-8-15(9-11-17)16-13-20(18-5-1-2-7-22(18)29)28-21(14-16)19-6-3-4-12-27-19/h1-14,29H
InChIKeyHRDNARNQJAOZSF-UHFFFAOYSA-N
XLogP6.20
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.38
LogP ≤ 56.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
SR2211
CID 51035449
NoName_714
CID 135489221
3-[5-(3-Hydroxyphenyl)pyridin-2-yl]phenol
CID 25093398
4''-(1-(Pyridin-4-yl)propyl)biphenyl-3-ol
CID 46854448
4''-(2-Methyl-1-(pyridin-4-yl)propyl)biphenyl-3-ol
CID 46854449
3-Fluoro-4''-(1-(pyridin-4-yl)propyl)biphenyl-4-ol
CID 46854606
4''-(Pyridin-4-ylmethyl)biphenyl-3-ol
CID 46901446
3-Fluoro-4''-(pyridin-4-ylmethyl)biphenyl-4-ol
CID 46901611
2,6-Difluoro-4-[4-[4-(4-methylpiperazin-1-yl)phenyl]pyridin-3-yl]phenol
CID 73010393
7-[(4-Ethylpiperazin-1-yl)-[4-(trifluoromethyl)phenyl]methyl]quinolin-8-ol
CID 3384730
3-Pyridinol, 5-benzyl-2-(piperidinomethyl)-
CID 744728

Frequently Asked Questions

What is the IUPAC name of 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol?
The IUPAC name of 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol (CID 136740466) is 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol.
What is the SMILES notation for 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol?
The canonical SMILES for 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol is Oc1ccccc1-c1cc(-c2ccc(C(F)(F)F)cc2)cc(-c2ccccn2)n1.
What is the InChIKey of 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol?
The InChIKey is HRDNARNQJAOZSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15F3N2O/c24-23(25,26)17-10-8-15(9-11-17)16-13-20(18-5-1-2-7-22(18)29)28-21(14-16)19-6-3-4-12-27-19/h1-14,29H.
What are the key properties of 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol?
2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol has a molecular weight of 392.38 g/mol, XLogP of 6.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-pyridin-2-yl-4-[4-(trifluoromethyl)phenyl]-2-pyridinyl]phenol is sourced from PubChem (CID 136740466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).