5-pyridin-3-yl-1,2-thiazole

C8H6N2S — CID 140618141

IUPAC5-pyridin-3-yl-1,2-thiazole
SMILESc1cncc(-c2ccns2)c1
InChIInChI=1S/C8H6N2S/c1-2-7(6-9-4-1)8-3-5-10-11-8/h1-6H
InChIKeyMHHUYETWKUBDEX-UHFFFAOYSA-N
MW162.22 g/mol
LogP2.21
Rot. Bonds1

About 5-pyridin-3-yl-1,2-thiazole

5-pyridin-3-yl-1,2-thiazole (PubChem CID 140618141) has the molecular formula C8H6N2S and a molecular weight of 162.22 g/mol. Its IUPAC name is 5-pyridin-3-yl-1,2-thiazole.

Molecular Properties

Compound Name5-pyridin-3-yl-1,2-thiazole
PubChem CID140618141
Molecular FormulaC8H6N2S
Molecular Weight162.22 g/mol
Exact Mass162.03
IUPAC Name5-pyridin-3-yl-1,2-thiazole
SMILESc1cncc(-c2ccns2)c1
InChIInChI=1S/C8H6N2S/c1-2-7(6-9-4-1)8-3-5-10-11-8/h1-6H
InChIKeyMHHUYETWKUBDEX-UHFFFAOYSA-N
XLogP2.21
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.22
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
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cyclopenta[c]azepine
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5-pyridin-3-yl-1,2,4-thiadiazole
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3-azulen-6-ylpyridine
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bis(2-methylpropane);3-pyridin-3-ylpyridine
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5-pyridin-3-ylthiophene-2-thiol
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3-(4-pyridin-3-ylthiophen-3-yl)pyridine
CID 46316707
3-(4-bromothiophen-2-yl)pyridine
CID 22180781
4-pyridin-3-ylaniline;dihydrochloride
CID 154574926
3-(1-methylpyrazol-4-yl)pyridine;dihydrochloride
CID 119106449
3,5-dipyridin-3-yl-1,2-oxazole
CID 14593332
2-pyridin-3-ylpyridine;dihydrochloride
CID 67024611

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-1,2-thiazole?
The IUPAC name of 5-pyridin-3-yl-1,2-thiazole (CID 140618141) is 5-pyridin-3-yl-1,2-thiazole.
What is the SMILES notation for 5-pyridin-3-yl-1,2-thiazole?
The canonical SMILES for 5-pyridin-3-yl-1,2-thiazole is c1cncc(-c2ccns2)c1.
What is the InChIKey of 5-pyridin-3-yl-1,2-thiazole?
The InChIKey is MHHUYETWKUBDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2S/c1-2-7(6-9-4-1)8-3-5-10-11-8/h1-6H.
What are the key properties of 5-pyridin-3-yl-1,2-thiazole?
5-pyridin-3-yl-1,2-thiazole has a molecular weight of 162.22 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-1,2-thiazole is sourced from PubChem (CID 140618141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).