6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile

C14H8N2S2 — CID 54590528

IUPAC6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cccs3)s2)nc1
InChIInChI=1S/C14H8N2S2/c15-8-10-3-4-11(16-9-10)12-5-6-14(18-12)13-2-1-7-17-13/h1-7,9H
InChIKeyZTWVANWGNYBAJS-UHFFFAOYSA-N
MW268.37 g/mol
LogP4.41
Rot. Bonds2

About 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile

6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile (PubChem CID 54590528) has the molecular formula C14H8N2S2 and a molecular weight of 268.37 g/mol. Its IUPAC name is 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile
PubChem CID54590528
Molecular FormulaC14H8N2S2
Molecular Weight268.37 g/mol
Exact Mass268.01
IUPAC Name6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cccs3)s2)nc1
InChIInChI=1S/C14H8N2S2/c15-8-10-3-4-11(16-9-10)12-5-6-14(18-12)13-2-1-7-17-13/h1-7,9H
InChIKeyZTWVANWGNYBAJS-UHFFFAOYSA-N
XLogP4.41
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.37
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile (CID 54590528) is 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile is N#Cc1ccc(-c2ccc(-c3cccs3)s2)nc1.
What is the InChIKey of 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile?
The InChIKey is ZTWVANWGNYBAJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2S2/c15-8-10-3-4-11(16-9-10)12-5-6-14(18-12)13-2-1-7-17-13/h1-7,9H.
What are the key properties of 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile?
6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile has a molecular weight of 268.37 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-thiophen-2-ylthiophen-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 54590528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).