2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine

C19H13N3S — CID 11329896

IUPAC2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine
SMILESc1ccc(-c2cc(-c3ccsc3)cc(-c3ccccn3)n2)nc1
InChIInChI=1S/C19H13N3S/c1-3-8-20-16(5-1)18-11-15(14-7-10-23-13-14)12-19(22-18)17-6-2-4-9-21-17/h1-13H
InChIKeyVMBVCIDRRJWWIK-UHFFFAOYSA-N
MW315.40 g/mol
LogP4.93
Rot. Bonds3

About 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine

2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine (PubChem CID 11329896) has the molecular formula C19H13N3S and a molecular weight of 315.40 g/mol. Its IUPAC name is 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine.

Molecular Properties

Compound Name2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine
PubChem CID11329896
Molecular FormulaC19H13N3S
Molecular Weight315.40 g/mol
Exact Mass315.08
IUPAC Name2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine
SMILESc1ccc(-c2cc(-c3ccsc3)cc(-c3ccccn3)n2)nc1
InChIInChI=1S/C19H13N3S/c1-3-8-20-16(5-1)18-11-15(14-7-10-23-13-14)12-19(22-18)17-6-2-4-9-21-17/h1-13H
InChIKeyVMBVCIDRRJWWIK-UHFFFAOYSA-N
XLogP4.93
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine?
The IUPAC name of 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine (CID 11329896) is 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine.
What is the SMILES notation for 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine?
The canonical SMILES for 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine is c1ccc(-c2cc(-c3ccsc3)cc(-c3ccccn3)n2)nc1.
What is the InChIKey of 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine?
The InChIKey is VMBVCIDRRJWWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3S/c1-3-8-20-16(5-1)18-11-15(14-7-10-23-13-14)12-19(22-18)17-6-2-4-9-21-17/h1-13H.
What are the key properties of 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine?
2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine has a molecular weight of 315.40 g/mol, XLogP of 4.93, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dipyridin-2-yl-4-thiophen-3-ylpyridine is sourced from PubChem (CID 11329896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).