4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine

C16H10F3N3O — CID 141419409

IUPAC4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine
SMILESFC(F)(F)c1cc(-c2cc(Oc3cccnc3)ccn2)ccn1
InChIInChI=1S/C16H10F3N3O/c17-16(18,19)15-8-11(3-6-22-15)14-9-12(4-7-21-14)23-13-2-1-5-20-10-13/h1-10H
InChIKeyANAZSBLQLSWOLS-UHFFFAOYSA-N
MW317.27 g/mol
LogP4.35
Rot. Bonds3

About 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine

4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine (PubChem CID 141419409) has the molecular formula C16H10F3N3O and a molecular weight of 317.27 g/mol. Its IUPAC name is 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine.

Molecular Properties

Compound Name4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine
PubChem CID141419409
Molecular FormulaC16H10F3N3O
Molecular Weight317.27 g/mol
Exact Mass317.08
IUPAC Name4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine
SMILESFC(F)(F)c1cc(-c2cc(Oc3cccnc3)ccn2)ccn1
InChIInChI=1S/C16H10F3N3O/c17-16(18,19)15-8-11(3-6-22-15)14-9-12(4-7-21-14)23-13-2-1-5-20-10-13/h1-10H
InChIKeyANAZSBLQLSWOLS-UHFFFAOYSA-N
XLogP4.35
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.27
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine?
The IUPAC name of 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine (CID 141419409) is 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine.
What is the SMILES notation for 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine?
The canonical SMILES for 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine is FC(F)(F)c1cc(-c2cc(Oc3cccnc3)ccn2)ccn1.
What is the InChIKey of 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine?
The InChIKey is ANAZSBLQLSWOLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N3O/c17-16(18,19)15-8-11(3-6-22-15)14-9-12(4-7-21-14)23-13-2-1-5-20-10-13/h1-10H.
What are the key properties of 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine?
4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine has a molecular weight of 317.27 g/mol, XLogP of 4.35, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-yloxy-2-[2-(trifluoromethyl)-4-pyridinyl]pyridine is sourced from PubChem (CID 141419409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).