2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole

C17H10FN5S — CID 53492740

IUPAC2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole
SMILESFc1cncc(-c2ncc(-c3cccc(-c4ncccn4)n3)s2)c1
InChIInChI=1S/C17H10FN5S/c18-12-7-11(8-19-9-12)17-22-10-15(24-17)13-3-1-4-14(23-13)16-20-5-2-6-21-16/h1-10H
InChIKeyLMBOBAWFGUTZRU-UHFFFAOYSA-N
MW335.37 g/mol
LogP3.86
Rot. Bonds3

About 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole

2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole (PubChem CID 53492740) has the molecular formula C17H10FN5S and a molecular weight of 335.37 g/mol. Its IUPAC name is 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole
PubChem CID53492740
Molecular FormulaC17H10FN5S
Molecular Weight335.37 g/mol
Exact Mass335.06
IUPAC Name2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole
SMILESFc1cncc(-c2ncc(-c3cccc(-c4ncccn4)n3)s2)c1
InChIInChI=1S/C17H10FN5S/c18-12-7-11(8-19-9-12)17-22-10-15(24-17)13-3-1-4-14(23-13)16-20-5-2-6-21-16/h1-10H
InChIKeyLMBOBAWFGUTZRU-UHFFFAOYSA-N
XLogP3.86
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Ulecaciclib
CID 126535127
4-[6-(4-Fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]imidazo[2,1-b][1,3]thiazol-5-yl]pyrimidin-2-amine
CID 44579300
2-(1,4''-Bipiperidin-1''-yl)-6-(6-fluoropyridin-3-yl)thiazolo[4,5-c]pyridine
CID 45482756
N-[6-(4-ethylpiperazin-1-yl)-2-methylpyrimidin-4-yl]-5-pyridin-4-yl-1,3-thiazol-2-amine;hydrochloride
CID 137355931
4-Methyl-6-[(4-methylphenyl)thio]-2-(2-pyridyl)pyrimidine
CID 2725934
N~4~,N~4~-Bis[(Pyridin-2-Yl)methyl]-6-(Thiophen-3-Yl)pyrimidine-2,4-Diamine
CID 124220259
2-(Pyridin-2-yl)-4-(m-tolylthio)pyrimidine
CID 11460152
6-(4-Fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole
CID 44579351
4-[4-(4-fluorophenyl)-2-(1-methylpiperidin-4-yl)-1,3-thiazol-5-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine
CID 145979645
4-[4-(4-fluorophenyl)-2-(1-methylpiperidin-4-yl)-1,3-thiazol-5-yl]-N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine
CID 145991173
4-[4-(4-fluorophenyl)-2-piperidin-4-yl-1,3-thiazol-5-yl]-N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine
CID 145991893
4-[4-(4-fluorophenyl)-2-piperidin-4-yl-1,3-thiazol-5-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine
CID 155546230

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole?
The IUPAC name of 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole (CID 53492740) is 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole?
The canonical SMILES for 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole is Fc1cncc(-c2ncc(-c3cccc(-c4ncccn4)n3)s2)c1.
What is the InChIKey of 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole?
The InChIKey is LMBOBAWFGUTZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10FN5S/c18-12-7-11(8-19-9-12)17-22-10-15(24-17)13-3-1-4-14(23-13)16-20-5-2-6-21-16/h1-10H.
What are the key properties of 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole?
2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole has a molecular weight of 335.37 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-3-pyridinyl)-5-(6-pyrimidin-2-yl-2-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 53492740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).