4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine

C17H11NOS2 — CID 46224852

IUPAC4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine
SMILESc1cc(-c2cc(-c3ccsc3)nc(-c3ccsc3)c2)co1
InChIInChI=1S/C17H11NOS2/c1-4-19-9-12(1)15-7-16(13-2-5-20-10-13)18-17(8-15)14-3-6-21-11-14/h1-11H
InChIKeyZZOCHQJBLYJTCK-UHFFFAOYSA-N
MW309.42 g/mol
LogP5.80
Rot. Bonds3

About 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine

4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine (PubChem CID 46224852) has the molecular formula C17H11NOS2 and a molecular weight of 309.42 g/mol. Its IUPAC name is 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine.

Molecular Properties

Compound Name4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine
PubChem CID46224852
Molecular FormulaC17H11NOS2
Molecular Weight309.42 g/mol
Exact Mass309.03
IUPAC Name4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine
SMILESc1cc(-c2cc(-c3ccsc3)nc(-c3ccsc3)c2)co1
InChIInChI=1S/C17H11NOS2/c1-4-19-9-12(1)15-7-16(13-2-5-20-10-13)18-17(8-15)14-3-6-21-11-14/h1-11H
InChIKeyZZOCHQJBLYJTCK-UHFFFAOYSA-N
XLogP5.80
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.42
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine?
The IUPAC name of 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine (CID 46224852) is 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine.
What is the SMILES notation for 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine?
The canonical SMILES for 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine is c1cc(-c2cc(-c3ccsc3)nc(-c3ccsc3)c2)co1.
What is the InChIKey of 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine?
The InChIKey is ZZOCHQJBLYJTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11NOS2/c1-4-19-9-12(1)15-7-16(13-2-5-20-10-13)18-17(8-15)14-3-6-21-11-14/h1-11H.
What are the key properties of 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine?
4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine has a molecular weight of 309.42 g/mol, XLogP of 5.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-3-yl)-2,6-di(thiophen-3-yl)pyridine is sourced from PubChem (CID 46224852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).