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

C16H14N2OS — CID 91135598

IUPAC2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
SMILESCOc1ccc(-c2nc(-c3cnccc3C)cs2)cc1
InChIInChI=1S/C16H14N2OS/c1-11-7-8-17-9-14(11)15-10-20-16(18-15)12-3-5-13(19-2)6-4-12/h3-10H,1-2H3
InChIKeyUDRKWQMBIPYRTH-UHFFFAOYSA-N
MW282.37 g/mol
LogP4.19
Rot. Bonds3

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

2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole (PubChem CID 91135598) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
PubChem CID91135598
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Name2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
SMILESCOc1ccc(-c2nc(-c3cnccc3C)cs2)cc1
InChIInChI=1S/C16H14N2OS/c1-11-7-8-17-9-14(11)15-10-20-16(18-15)12-3-5-13(19-2)6-4-12/h3-10H,1-2H3
InChIKeyUDRKWQMBIPYRTH-UHFFFAOYSA-N
XLogP4.19
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole
CID 22049802
4-(2,4-dimethoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
CID 23408094
2-(2-chlorophenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91378887
2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]aniline
CID 61268827
2-(2,3-dihydro-1-benzofuran-5-yl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91013706
2-(4-methoxyphenyl)-4-phenyl-1,3-thiazole;hydrobromide
CID 171114672
2-(4-methoxyphenyl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole
CID 162536924
4-[2-(4-methyl-3-pyridinyl)-1,3-thiazol-4-yl]benzamide
CID 22049680
4-(2,4-dichlorophenyl)-2-(4-methyl-3-pyridinyl)-1,3-thiazole;hydrochloride
CID 67551034
N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide
CID 22049767
4-(4-methoxy-3-methylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 885223
2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-5-(trifluoromethyl)phenol
CID 146186096

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole?
The IUPAC name of 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole (CID 91135598) is 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole?
The canonical SMILES for 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole is COc1ccc(-c2nc(-c3cnccc3C)cs2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole?
The InChIKey is UDRKWQMBIPYRTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS/c1-11-7-8-17-9-14(11)15-10-20-16(18-15)12-3-5-13(19-2)6-4-12/h3-10H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole?
2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole has a molecular weight of 282.37 g/mol, XLogP of 4.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 91135598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).