5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine

C24H14F6N2O — CID 88752673

IUPAC5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccccc2Oc2ccccc2-c2ccc(C(F)(F)F)cn2)nc1
InChIInChI=1S/C24H14F6N2O/c25-23(26,27)15-9-11-19(31-13-15)17-5-1-3-7-21(17)33-22-8-4-2-6-18(22)20-12-10-16(14-32-20)24(28,29)30/h1-14H
InChIKeyTZJPFXICXRWNFF-UHFFFAOYSA-N
MW460.38 g/mol
LogP7.64
Rot. Bonds4

About 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine

5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine (PubChem CID 88752673) has the molecular formula C24H14F6N2O and a molecular weight of 460.38 g/mol. Its IUPAC name is 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine.

Molecular Properties

Compound Name5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine
PubChem CID88752673
Molecular FormulaC24H14F6N2O
Molecular Weight460.38 g/mol
Exact Mass460.10
IUPAC Name5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccccc2Oc2ccccc2-c2ccc(C(F)(F)F)cn2)nc1
InChIInChI=1S/C24H14F6N2O/c25-23(26,27)15-9-11-19(31-13-15)17-5-1-3-7-21(17)33-22-8-4-2-6-18(22)20-12-10-16(14-32-20)24(28,29)30/h1-14H
InChIKeyTZJPFXICXRWNFF-UHFFFAOYSA-N
XLogP7.64
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.38
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine?
The IUPAC name of 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine (CID 88752673) is 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine.
What is the SMILES notation for 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine?
The canonical SMILES for 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine is FC(F)(F)c1ccc(-c2ccccc2Oc2ccccc2-c2ccc(C(F)(F)F)cn2)nc1.
What is the InChIKey of 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine?
The InChIKey is TZJPFXICXRWNFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H14F6N2O/c25-23(26,27)15-9-11-19(31-13-15)17-5-1-3-7-21(17)33-22-8-4-2-6-18(22)20-12-10-16(14-32-20)24(28,29)30/h1-14H.
What are the key properties of 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine?
5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine has a molecular weight of 460.38 g/mol, XLogP of 7.64, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(trifluoromethyl)-2-[2-[2-[5-(trifluoromethyl)-2-pyridinyl]phenoxy]phenyl]pyridine is sourced from PubChem (CID 88752673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).