2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine

C18H12N2S2 — CID 15778483

IUPAC2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine
SMILESc1ccc(-c2ccc(-c3ccc(-c4ccccn4)s3)s2)nc1
InChIInChI=1S/C18H12N2S2/c1-3-11-19-13(5-1)15-7-9-17(21-15)18-10-8-16(22-18)14-6-2-4-12-20-14/h1-12H
InChIKeyIZKXKAAXGRKILB-UHFFFAOYSA-N
MW320.44 g/mol
LogP5.60
Rot. Bonds3

About 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine

2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine (PubChem CID 15778483) has the molecular formula C18H12N2S2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine.

Molecular Properties

Compound Name2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine
PubChem CID15778483
Molecular FormulaC18H12N2S2
Molecular Weight320.44 g/mol
Exact Mass320.04
IUPAC Name2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine
SMILESc1ccc(-c2ccc(-c3ccc(-c4ccccn4)s3)s2)nc1
InChIInChI=1S/C18H12N2S2/c1-3-11-19-13(5-1)15-7-9-17(21-15)18-10-8-16(22-18)14-6-2-4-12-20-14/h1-12H
InChIKeyIZKXKAAXGRKILB-UHFFFAOYSA-N
XLogP5.60
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.44
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine?
The IUPAC name of 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine (CID 15778483) is 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine.
What is the SMILES notation for 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine?
The canonical SMILES for 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine is c1ccc(-c2ccc(-c3ccc(-c4ccccn4)s3)s2)nc1.
What is the InChIKey of 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine?
The InChIKey is IZKXKAAXGRKILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2S2/c1-3-11-19-13(5-1)15-7-9-17(21-15)18-10-8-16(22-18)14-6-2-4-12-20-14/h1-12H.
What are the key properties of 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine?
2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine has a molecular weight of 320.44 g/mol, XLogP of 5.60, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]pyridine is sourced from PubChem (CID 15778483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).