4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine

C12H6F6N2 — CID 12058766

IUPAC4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine
SMILESFC(F)(F)c1ccnc(-c2cc(C(F)(F)F)ccn2)c1
InChIInChI=1S/C12H6F6N2/c13-11(14,15)7-1-3-19-9(5-7)10-6-8(2-4-20-10)12(16,17)18/h1-6H
InChIKeyFFOMEQIMPYKURW-UHFFFAOYSA-N
MW292.18 g/mol
LogP4.18
Rot. Bonds1

About 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine

4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine (PubChem CID 12058766) has the molecular formula C12H6F6N2 and a molecular weight of 292.18 g/mol. Its IUPAC name is 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine
PubChem CID12058766
Molecular FormulaC12H6F6N2
Molecular Weight292.18 g/mol
Exact Mass292.04
IUPAC Name4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine
SMILESFC(F)(F)c1ccnc(-c2cc(C(F)(F)F)ccn2)c1
InChIInChI=1S/C12H6F6N2/c13-11(14,15)7-1-3-19-9(5-7)10-6-8(2-4-20-10)12(16,17)18/h1-6H
InChIKeyFFOMEQIMPYKURW-UHFFFAOYSA-N
XLogP4.18
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine?
The IUPAC name of 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine (CID 12058766) is 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine.
What is the SMILES notation for 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine?
The canonical SMILES for 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine is FC(F)(F)c1ccnc(-c2cc(C(F)(F)F)ccn2)c1.
What is the InChIKey of 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine?
The InChIKey is FFOMEQIMPYKURW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F6N2/c13-11(14,15)7-1-3-19-9(5-7)10-6-8(2-4-20-10)12(16,17)18/h1-6H.
What are the key properties of 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine?
4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine has a molecular weight of 292.18 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trifluoromethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]pyridine is sourced from PubChem (CID 12058766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).