4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine

C13H10F4N2O — CID 103174614

IUPAC4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine
SMILESCCc1nc(C)ccc1Oc1c(F)c(F)nc(F)c1F
InChIInChI=1S/C13H10F4N2O/c1-3-7-8(5-4-6(2)18-7)20-11-9(14)12(16)19-13(17)10(11)15/h4-5H,3H2,1-2H3
InChIKeyZUMNYHNNNKMNBW-UHFFFAOYSA-N
MW286.23 g/mol
LogP3.70
Rot. Bonds3

About 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine

4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine (PubChem CID 103174614) has the molecular formula C13H10F4N2O and a molecular weight of 286.23 g/mol. Its IUPAC name is 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine.

Molecular Properties

Compound Name4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine
PubChem CID103174614
Molecular FormulaC13H10F4N2O
Molecular Weight286.23 g/mol
Exact Mass286.07
IUPAC Name4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine
SMILESCCc1nc(C)ccc1Oc1c(F)c(F)nc(F)c1F
InChIInChI=1S/C13H10F4N2O/c1-3-7-8(5-4-6(2)18-7)20-11-9(14)12(16)19-13(17)10(11)15/h4-5H,3H2,1-2H3
InChIKeyZUMNYHNNNKMNBW-UHFFFAOYSA-N
XLogP3.70
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.23
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine?
The IUPAC name of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine (CID 103174614) is 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine.
What is the SMILES notation for 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine?
The canonical SMILES for 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine is CCc1nc(C)ccc1Oc1c(F)c(F)nc(F)c1F.
What is the InChIKey of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine?
The InChIKey is ZUMNYHNNNKMNBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F4N2O/c1-3-7-8(5-4-6(2)18-7)20-11-9(14)12(16)19-13(17)10(11)15/h4-5H,3H2,1-2H3.
What are the key properties of 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine?
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine has a molecular weight of 286.23 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2,3,5,6-tetrafluoropyridine is sourced from PubChem (CID 103174614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).