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

C14H11N3S — CID 22049802

IUPAC4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole
SMILESCc1ccncc1-c1csc(-c2ccncc2)n1
InChIInChI=1S/C14H11N3S/c1-10-2-5-16-8-12(10)13-9-18-14(17-13)11-3-6-15-7-4-11/h2-9H,1H3
InChIKeyYPSCEIZQQIFJTE-UHFFFAOYSA-N
MW253.33 g/mol
LogP3.58
Rot. Bonds2

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

4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole (PubChem CID 22049802) has the molecular formula C14H11N3S and a molecular weight of 253.33 g/mol. Its IUPAC name is 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole
PubChem CID22049802
Molecular FormulaC14H11N3S
Molecular Weight253.33 g/mol
Exact Mass253.07
IUPAC Name4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole
SMILESCc1ccncc1-c1csc(-c2ccncc2)n1
InChIInChI=1S/C14H11N3S/c1-10-2-5-16-8-12(10)13-9-18-14(17-13)11-3-6-15-7-4-11/h2-9H,1H3
InChIKeyYPSCEIZQQIFJTE-UHFFFAOYSA-N
XLogP3.58
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91135598
2-(2-chlorophenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91378887
2-(2,3-dihydro-1-benzofuran-5-yl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91013706
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-[2-(4-methyl-3-pyridinyl)-1,3-thiazol-4-yl]benzamide
CID 22049680
6-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-pyridin-2-one
CID 10355730
4-(4-methylphenyl)-2-(4-phenyl-3-pyridinyl)-1,3-thiazole
CID 90735429
4-methyl-2-pyridin-4-yl-1,3-thiazole;hydrochloride
CID 54605031
2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole
CID 86217272
4-(2,4-dimethoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
CID 23408094
2-pyridin-4-yl-4-thiophen-2-yl-1,3-thiazole
CID 100596517

Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole?
The IUPAC name of 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole (CID 22049802) is 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole.
What is the SMILES notation for 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole?
The canonical SMILES for 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole is Cc1ccncc1-c1csc(-c2ccncc2)n1.
What is the InChIKey of 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole?
The InChIKey is YPSCEIZQQIFJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3S/c1-10-2-5-16-8-12(10)13-9-18-14(17-13)11-3-6-15-7-4-11/h2-9H,1H3.
What are the key properties of 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole?
4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole has a molecular weight of 253.33 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole is sourced from PubChem (CID 22049802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).