4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine

C21H15N3O — CID 132918530

IUPAC4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine
SMILESC(=C/c1ccco1)\c1cc(-c2ccccn2)nc(-c2ccccn2)c1
InChIInChI=1S/C21H15N3O/c1-3-11-22-18(7-1)20-14-16(9-10-17-6-5-13-25-17)15-21(24-20)19-8-2-4-12-23-19/h1-15H/b10-9+
InChIKeyDOXRZBKRJVCTEK-MDZDMXLPSA-N
MW325.37 g/mol
LogP4.97
Rot. Bonds4

About 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine

4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine (PubChem CID 132918530) has the molecular formula C21H15N3O and a molecular weight of 325.37 g/mol. Its IUPAC name is 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine.

Molecular Properties

Compound Name4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine
PubChem CID132918530
Molecular FormulaC21H15N3O
Molecular Weight325.37 g/mol
Exact Mass325.12
IUPAC Name4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine
SMILESC(=C/c1ccco1)\c1cc(-c2ccccn2)nc(-c2ccccn2)c1
InChIInChI=1S/C21H15N3O/c1-3-11-22-18(7-1)20-14-16(9-10-17-6-5-13-25-17)15-21(24-20)19-8-2-4-12-23-19/h1-15H/b10-9+
InChIKeyDOXRZBKRJVCTEK-MDZDMXLPSA-N
XLogP4.97
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(furan-2-yl)-2,6-dipyridin-2-ylpyridine
CID 11434639
2-[(E)-2-phenylethenyl]furan
CID 642118
4-(furan-2-yl)-2-pyridin-2-yl-6-pyridin-4-ylpyridine
CID 101132495
3-[2-(furan-2-yl)ethenyl]pyridine
CID 54559781
4-[2-(2-pyridin-2-yl-4-pyridinyl)ethenyl]benzaldehyde
CID 54562489
2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-[2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-pyridinyl]pyridine
CID 15448140
pyrrolo[3,2-b]azepine
CID 66934182
2-[2-[3,5-bis(2-pyridin-2-ylethenyl)phenyl]ethenyl]pyridine
CID 5076981
2,4,6-tripyridin-2-ylpyrimidine
CID 70005539
4-chloro-2,6-dipyridin-2-ylpyridine;platinum
CID 87267165
4-[6-[6-(2,6-dipyridin-2-yl-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]-2,6-dipyridin-2-ylpyridine
CID 171935887
bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane
CID 177455592

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine?
The IUPAC name of 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine (CID 132918530) is 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine.
What is the SMILES notation for 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine?
The canonical SMILES for 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine is C(=C/c1ccco1)\c1cc(-c2ccccn2)nc(-c2ccccn2)c1.
What is the InChIKey of 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine?
The InChIKey is DOXRZBKRJVCTEK-MDZDMXLPSA-N. The full InChI is InChI=1S/C21H15N3O/c1-3-11-22-18(7-1)20-14-16(9-10-17-6-5-13-25-17)15-21(24-20)19-8-2-4-12-23-19/h1-15H/b10-9+.
What are the key properties of 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine?
4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine has a molecular weight of 325.37 g/mol, XLogP of 4.97, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(furan-2-yl)ethenyl]-2,6-dipyridin-2-ylpyridine is sourced from PubChem (CID 132918530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).