3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine

C12H8N4S — CID 166611151

IUPAC3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine
SMILESc1ccc(-c2ncc(-c3ccsc3)nn2)nc1
InChIInChI=1S/C12H8N4S/c1-2-5-13-10(3-1)12-14-7-11(15-16-12)9-4-6-17-8-9/h1-8H
InChIKeyHGSYFJLKVLHZKL-UHFFFAOYSA-N
MW240.29 g/mol
LogP2.66
Rot. Bonds2

About 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine

3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine (PubChem CID 166611151) has the molecular formula C12H8N4S and a molecular weight of 240.29 g/mol. Its IUPAC name is 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine.

Molecular Properties

Compound Name3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine
PubChem CID166611151
Molecular FormulaC12H8N4S
Molecular Weight240.29 g/mol
Exact Mass240.05
IUPAC Name3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine
SMILESc1ccc(-c2ncc(-c3ccsc3)nn2)nc1
InChIInChI=1S/C12H8N4S/c1-2-5-13-10(3-1)12-14-7-11(15-16-12)9-4-6-17-8-9/h1-8H
InChIKeyHGSYFJLKVLHZKL-UHFFFAOYSA-N
XLogP2.66
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.29
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3-(Thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-6-yl]pyridine
CID 5329467
3-((Pyridin-3-ylmethyl)thio)-6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 16194785
2,3-Dimethyl-6-thiophen-2-ylimidazo[1,2-b][1,2,4]triazine
CID 615484
1-(4-fluoro-benzyl)-6-thiophen-2-yl-1H-[1,2,3]triazolo[4,5-b]pyrazine
CID 11738454
3-(4-Fluoro-benzyl)-6-th iophen-2-yl-[1,2,4]triazolo[4,3-b][1,2,4]triazine
CID 11771327
3-((Pyridin-2-ylmethyl)thio)-6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 16194810
2-[[5-(1-Methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]thieno[3,2-c]pyridine
CID 53262575
3-Imidazol-1-ylmethyl-2-thiophen-2-yl-pyridine
CID 57329793
3-(6-Quinolylmethyl)-6-(2-thienyl)[1,2,4]triazolo[4,3-b][1,2,4]triazine
CID 57405873
5-Imidazol-1-ylmethyl-2-thiophen-3-yl-pyridine
CID 67515607
US9096589, 5,8-Dimethyl-2-[2-(1-methyl-4-thiophen-2-yl-1H-imidazol-2-yl)-ethyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 53250350
2-[(4-Methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine
CID 644679

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine?
The IUPAC name of 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine (CID 166611151) is 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine.
What is the SMILES notation for 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine?
The canonical SMILES for 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine is c1ccc(-c2ncc(-c3ccsc3)nn2)nc1.
What is the InChIKey of 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine?
The InChIKey is HGSYFJLKVLHZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N4S/c1-2-5-13-10(3-1)12-14-7-11(15-16-12)9-4-6-17-8-9/h1-8H.
What are the key properties of 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine?
3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine has a molecular weight of 240.29 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yl-6-thiophen-3-yl-1,2,4-triazine is sourced from PubChem (CID 166611151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).