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

C19H13NO2S — CID 10064551

IUPAC4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine
SMILESC(=C/c1ccco1)\c1cc(-c2ccco2)cc(-c2cccs2)n1
InChIInChI=1S/C19H13NO2S/c1-4-16(21-9-1)8-7-15-12-14(18-5-2-10-22-18)13-17(20-15)19-6-3-11-23-19/h1-13H/b8-7+
InChIKeyDHYLSWKGDIQDSJ-BQYQJAHWSA-N
MW319.38 g/mol
LogP5.83
Rot. Bonds4

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

4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine (PubChem CID 10064551) has the molecular formula C19H13NO2S and a molecular weight of 319.38 g/mol. Its IUPAC name is 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine.

Molecular Properties

Compound Name4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine
PubChem CID10064551
Molecular FormulaC19H13NO2S
Molecular Weight319.38 g/mol
Exact Mass319.07
IUPAC Name4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine
SMILESC(=C/c1ccco1)\c1cc(-c2ccco2)cc(-c2cccs2)n1
InChIInChI=1S/C19H13NO2S/c1-4-16(21-9-1)8-7-15-12-14(18-5-2-10-22-18)13-17(20-15)19-6-3-11-23-19/h1-13H/b8-7+
InChIKeyDHYLSWKGDIQDSJ-BQYQJAHWSA-N
XLogP5.83
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.38
LogP ≤ 55.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine?
The IUPAC name of 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine (CID 10064551) is 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine.
What is the SMILES notation for 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine?
The canonical SMILES for 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine is C(=C/c1ccco1)\c1cc(-c2ccco2)cc(-c2cccs2)n1.
What is the InChIKey of 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine?
The InChIKey is DHYLSWKGDIQDSJ-BQYQJAHWSA-N. The full InChI is InChI=1S/C19H13NO2S/c1-4-16(21-9-1)8-7-15-12-14(18-5-2-10-22-18)13-17(20-15)19-6-3-11-23-19/h1-13H/b8-7+.
What are the key properties of 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine?
4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine has a molecular weight of 319.38 g/mol, XLogP of 5.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-2-[(E)-2-(furan-2-yl)ethenyl]-6-thiophen-2-ylpyridine is sourced from PubChem (CID 10064551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).