2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine

C24H17F3N2O — CID 11531564

IUPAC2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine
SMILESFC(F)(F)Oc1ccc(Nc2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1
InChIInChI=1S/C24H17F3N2O/c25-24(26,27)30-21-13-11-19(12-14-21)28-20-15-22(17-7-3-1-4-8-17)29-23(16-20)18-9-5-2-6-10-18/h1-16H,(H,28,29)
InChIKeyPOKIEJUFFMNQHY-UHFFFAOYSA-N
MW406.41 g/mol
LogP7.06
Rot. Bonds5

About 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine

2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine (PubChem CID 11531564) has the molecular formula C24H17F3N2O and a molecular weight of 406.41 g/mol. Its IUPAC name is 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine.

Molecular Properties

Compound Name2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine
PubChem CID11531564
Molecular FormulaC24H17F3N2O
Molecular Weight406.41 g/mol
Exact Mass406.13
IUPAC Name2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine
SMILESFC(F)(F)Oc1ccc(Nc2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1
InChIInChI=1S/C24H17F3N2O/c25-24(26,27)30-21-13-11-19(12-14-21)28-20-15-22(17-7-3-1-4-8-17)29-23(16-20)18-9-5-2-6-10-18/h1-16H,(H,28,29)
InChIKeyPOKIEJUFFMNQHY-UHFFFAOYSA-N
XLogP7.06
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.41
LogP ≤ 57.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine?
The IUPAC name of 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine (CID 11531564) is 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine.
What is the SMILES notation for 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine?
The canonical SMILES for 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine is FC(F)(F)Oc1ccc(Nc2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1.
What is the InChIKey of 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine?
The InChIKey is POKIEJUFFMNQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F3N2O/c25-24(26,27)30-21-13-11-19(12-14-21)28-20-15-22(17-7-3-1-4-8-17)29-23(16-20)18-9-5-2-6-10-18/h1-16H,(H,28,29).
What are the key properties of 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine?
2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine has a molecular weight of 406.41 g/mol, XLogP of 7.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenyl-N-[4-(trifluoromethoxy)phenyl]pyridin-4-amine is sourced from PubChem (CID 11531564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).