3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one

C14H14N2OS2 — CID 129012672

IUPAC3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2c2sccc2C)n1
InChIInChI=1S/C14H14N2OS2/c1-9-6-7-18-13(9)14-16(12(17)8-19-14)11-5-3-4-10(2)15-11/h3-7,14H,8H2,1-2H3
InChIKeyUHPAMAYDFAGJAF-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.54
Rot. Bonds2

About 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one

3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one (PubChem CID 129012672) has the molecular formula C14H14N2OS2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one
PubChem CID129012672
Molecular FormulaC14H14N2OS2
Molecular Weight290.41 g/mol
Exact Mass290.05
IUPAC Name3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2c2sccc2C)n1
InChIInChI=1S/C14H14N2OS2/c1-9-6-7-18-13(9)14-16(12(17)8-19-14)11-5-3-4-10(2)15-11/h3-7,14H,8H2,1-2H3
InChIKeyUHPAMAYDFAGJAF-UHFFFAOYSA-N
XLogP3.54
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one?
The IUPAC name of 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one (CID 129012672) is 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one is Cc1cccc(N2C(=O)CSC2c2sccc2C)n1.
What is the InChIKey of 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one?
The InChIKey is UHPAMAYDFAGJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2OS2/c1-9-6-7-18-13(9)14-16(12(17)8-19-14)11-5-3-4-10(2)15-11/h3-7,14H,8H2,1-2H3.
What are the key properties of 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one?
3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one has a molecular weight of 290.41 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 129012672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).