2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine

C24H14F6N2 — CID 101422913

IUPAC2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccc(C(F)(F)F)cc2-c2ccccn2)c(-c2ccccn2)c1
InChIInChI=1S/C24H14F6N2/c25-23(26,27)15-7-9-17(19(13-15)21-5-1-3-11-31-21)18-10-8-16(24(28,29)30)14-20(18)22-6-2-4-12-32-22/h1-14H
InChIKeyOUBADLNJKILKNP-UHFFFAOYSA-N
MW444.38 g/mol
LogP7.52
Rot. Bonds3

About 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine

2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine (PubChem CID 101422913) has the molecular formula C24H14F6N2 and a molecular weight of 444.38 g/mol. Its IUPAC name is 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine
PubChem CID101422913
Molecular FormulaC24H14F6N2
Molecular Weight444.38 g/mol
Exact Mass444.11
IUPAC Name2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccc(C(F)(F)F)cc2-c2ccccn2)c(-c2ccccn2)c1
InChIInChI=1S/C24H14F6N2/c25-23(26,27)15-7-9-17(19(13-15)21-5-1-3-11-31-21)18-10-8-16(24(28,29)30)14-20(18)22-6-2-4-12-32-22/h1-14H
InChIKeyOUBADLNJKILKNP-UHFFFAOYSA-N
XLogP7.52
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.38
LogP ≤ 57.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Azatadine
CID 19861
2,3'-Bipyridine
CID 11389
Benzo(h)quinoline
CID 9191
2,4'-Bipyridine
CID 68488
BC-1215
CID 72201045
3-Phenylisoquinoline
CID 609614
1-Phenylisoquinoline
CID 137882
6,6'-Biquinoline
CID 620711
2-(2-(3-Pyridinyl)ethyl)pyridine
CID 248743
4,4'-Diphenyl-2,2'-bipyridine
CID 80259
6-Pyridin-3-yl-2-naphthonitrile
CID 11601068
3-(Naphthalen-2-yl)pyridine
CID 11845485

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine (CID 101422913) is 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine is FC(F)(F)c1ccc(-c2ccc(C(F)(F)F)cc2-c2ccccn2)c(-c2ccccn2)c1.
What is the InChIKey of 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine?
The InChIKey is OUBADLNJKILKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H14F6N2/c25-23(26,27)15-7-9-17(19(13-15)21-5-1-3-11-31-21)18-10-8-16(24(28,29)30)14-20(18)22-6-2-4-12-32-22/h1-14H.
What are the key properties of 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine?
2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine has a molecular weight of 444.38 g/mol, XLogP of 7.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-pyridin-2-yl-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 101422913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).