3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine

C19H13NOS — CID 169265449

IUPAC3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine
SMILESc1ccc(-c2ccc(-c3cncc(-c4cccs4)c3)o2)cc1
InChIInChI=1S/C19H13NOS/c1-2-5-14(6-3-1)17-8-9-18(21-17)15-11-16(13-20-12-15)19-7-4-10-22-19/h1-13H
InChIKeyBHXOLJXUHDSLKB-UHFFFAOYSA-N
MW303.39 g/mol
LogP5.74
Rot. Bonds3

About 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine

3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine (PubChem CID 169265449) has the molecular formula C19H13NOS and a molecular weight of 303.39 g/mol. Its IUPAC name is 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine.

Molecular Properties

Compound Name3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine
PubChem CID169265449
Molecular FormulaC19H13NOS
Molecular Weight303.39 g/mol
Exact Mass303.07
IUPAC Name3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine
SMILESc1ccc(-c2ccc(-c3cncc(-c4cccs4)c3)o2)cc1
InChIInChI=1S/C19H13NOS/c1-2-5-14(6-3-1)17-8-9-18(21-17)15-11-16(13-20-12-15)19-7-4-10-22-19/h1-13H
InChIKeyBHXOLJXUHDSLKB-UHFFFAOYSA-N
XLogP5.74
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.39
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine?
The IUPAC name of 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine (CID 169265449) is 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine.
What is the SMILES notation for 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine?
The canonical SMILES for 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine is c1ccc(-c2ccc(-c3cncc(-c4cccs4)c3)o2)cc1.
What is the InChIKey of 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine?
The InChIKey is BHXOLJXUHDSLKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NOS/c1-2-5-14(6-3-1)17-8-9-18(21-17)15-11-16(13-20-12-15)19-7-4-10-22-19/h1-13H.
What are the key properties of 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine?
3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine has a molecular weight of 303.39 g/mol, XLogP of 5.74, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenylfuran-2-yl)-5-thiophen-2-ylpyridine is sourced from PubChem (CID 169265449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).