4-(4-methyl-2-pyridinyl)-1,3-thiazole

C9H8N2S — CID 131134487

IUPAC4-(4-methyl-2-pyridinyl)-1,3-thiazole
SMILESCc1ccnc(-c2cscn2)c1
InChIInChI=1S/C9H8N2S/c1-7-2-3-10-8(4-7)9-5-12-6-11-9/h2-6H,1H3
InChIKeyPLKDPHIDYRFVOW-UHFFFAOYSA-N
MW176.24 g/mol
LogP2.51
Rot. Bonds1

About 4-(4-methyl-2-pyridinyl)-1,3-thiazole

4-(4-methyl-2-pyridinyl)-1,3-thiazole (PubChem CID 131134487) has the molecular formula C9H8N2S and a molecular weight of 176.24 g/mol. Its IUPAC name is 4-(4-methyl-2-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(4-methyl-2-pyridinyl)-1,3-thiazole
PubChem CID131134487
Molecular FormulaC9H8N2S
Molecular Weight176.24 g/mol
Exact Mass176.04
IUPAC Name4-(4-methyl-2-pyridinyl)-1,3-thiazole
SMILESCc1ccnc(-c2cscn2)c1
InChIInChI=1S/C9H8N2S/c1-7-2-3-10-8(4-7)9-5-12-6-11-9/h2-6H,1H3
InChIKeyPLKDPHIDYRFVOW-UHFFFAOYSA-N
XLogP2.51
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.24
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

tris(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);ruthenium(2+)
CID 154828609
copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
CID 23557697
4-methyl-2-(4-methyl-2-pyridinyl)pyridine;oxovanadium
CID 139924983
dichlororuthenium;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
CID 11261228
4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-pyridin-2-ylpyridine
CID 158258168
4-methyl-2-pyridin-2-ylpyridine
CID 11019291
4-methyl-2-pyridin-2-ylpyridine;bis(2-pyridin-2-ylpyridine);ruthenium
CID 59651145
ethane;2-(4-fluoro-2-pyridinyl)-4-methylpyridine
CID 170630343
4-methyl-2-(1-methylpyrazol-3-yl)pyridine
CID 130225331
4-methyl-2-[3-(4-methyl-2-pyridinyl)-1H-pyrazol-5-yl]pyridine
CID 101227745
4-(2-ethylpyrimidin-4-yl)-1,3-thiazole
CID 160538111
2,9-dimethyl-1,10-phenanthroline;4-methyl-2-(4-methyl-2-pyridinyl)pyridine
CID 158581624

Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-2-pyridinyl)-1,3-thiazole?
The IUPAC name of 4-(4-methyl-2-pyridinyl)-1,3-thiazole (CID 131134487) is 4-(4-methyl-2-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 4-(4-methyl-2-pyridinyl)-1,3-thiazole?
The canonical SMILES for 4-(4-methyl-2-pyridinyl)-1,3-thiazole is Cc1ccnc(-c2cscn2)c1.
What is the InChIKey of 4-(4-methyl-2-pyridinyl)-1,3-thiazole?
The InChIKey is PLKDPHIDYRFVOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2S/c1-7-2-3-10-8(4-7)9-5-12-6-11-9/h2-6H,1H3.
What are the key properties of 4-(4-methyl-2-pyridinyl)-1,3-thiazole?
4-(4-methyl-2-pyridinyl)-1,3-thiazole has a molecular weight of 176.24 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-2-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 131134487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).