2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one

C16H15FN2O2S — CID 513677

IUPAC2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
SMILESCOc1cccc(F)c1C1SCC(=O)N1c1cccc(C)n1
InChIInChI=1S/C16H15FN2O2S/c1-10-5-3-8-13(18-10)19-14(20)9-22-16(19)15-11(17)6-4-7-12(15)21-2/h3-8,16H,9H2,1-2H3
InChIKeyIFPUJNLEWSPVFT-UHFFFAOYSA-N
MW318.37 g/mol
LogP3.32
Rot. Bonds3

About 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one

2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one (PubChem CID 513677) has the molecular formula C16H15FN2O2S and a molecular weight of 318.37 g/mol. Its IUPAC name is 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
PubChem CID513677
Molecular FormulaC16H15FN2O2S
Molecular Weight318.37 g/mol
Exact Mass318.08
IUPAC Name2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
SMILESCOc1cccc(F)c1C1SCC(=O)N1c1cccc(C)n1
InChIInChI=1S/C16H15FN2O2S/c1-10-5-3-8-13(18-10)19-14(20)9-22-16(19)15-11(17)6-4-7-12(15)21-2/h3-8,16H,9H2,1-2H3
InChIKeyIFPUJNLEWSPVFT-UHFFFAOYSA-N
XLogP3.32
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.37
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(6-bromo-2-pyridinyl)-2-(2-fluoro-6-methoxyphenyl)-1,3-thiazolidin-4-one
CID 513682
2-(2,6-dimethoxyphenyl)-3-(4-methylpyrimidin-2-yl)-1,3-thiazolidin-4-one
CID 513696
2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 57390348
2-(2-fluoro-6-methoxyphenyl)-3-(naphthalen-1-ylmethyl)-1,3-thiazolidin-4-one
CID 87150934
2-(2-chloro-6-fluorophenyl)-3-(4-methoxy-6-methylpyrimidin-2-yl)-1,3-thiazolidin-4-one
CID 3012196
2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 16728779
2-(2,6-dimethylphenyl)-3-(4,6-dimethyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 513686
3-[(2,5-difluorophenyl)methyl]-2-(2,6-dimethoxyphenyl)-1,3-thiazolidin-4-one
CID 3842250
2-(2,6-difluorophenyl)-3-pyrimidin-2-yl-1,3-thiazolidin-4-one
CID 3012187
2-[2-fluoro-6-(trifluoromethyl)phenyl]-3-(4-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 44582934
2-(2,6-dichlorophenyl)-3-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-thiazolidin-4-one
CID 71521936
3-[(2,6-difluorophenyl)methyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazolidin-4-one
CID 3388079

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one (CID 513677) is 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one is COc1cccc(F)c1C1SCC(=O)N1c1cccc(C)n1.
What is the InChIKey of 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The InChIKey is IFPUJNLEWSPVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O2S/c1-10-5-3-8-13(18-10)19-14(20)9-22-16(19)15-11(17)6-4-7-12(15)21-2/h3-8,16H,9H2,1-2H3.
What are the key properties of 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one has a molecular weight of 318.37 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 513677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).