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

C14H14N2OS2 — CID 129012674

IUPAC5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)C(C)SC2c2cccs2)n1
InChIInChI=1S/C14H14N2OS2/c1-9-5-3-7-12(15-9)16-13(17)10(2)19-14(16)11-6-4-8-18-11/h3-8,10,14H,1-2H3
InChIKeyCTVQZQKNNHVMAE-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.62
Rot. Bonds2

About 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (PubChem CID 129012674) has the molecular formula C14H14N2OS2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
PubChem CID129012674
Molecular FormulaC14H14N2OS2
Molecular Weight290.41 g/mol
Exact Mass290.05
IUPAC Name5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)C(C)SC2c2cccs2)n1
InChIInChI=1S/C14H14N2OS2/c1-9-5-3-7-12(15-9)16-13(17)10(2)19-14(16)11-6-4-8-18-11/h3-8,10,14H,1-2H3
InChIKeyCTVQZQKNNHVMAE-UHFFFAOYSA-N
XLogP3.62
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 ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The IUPAC name of 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (CID 129012674) is 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is Cc1cccc(N2C(=O)C(C)SC2c2cccs2)n1.
What is the InChIKey of 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The InChIKey is CTVQZQKNNHVMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2OS2/c1-9-5-3-7-12(15-9)16-13(17)10(2)19-14(16)11-6-4-8-18-11/h3-8,10,14H,1-2H3.
What are the key properties of 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one has a molecular weight of 290.41 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(6-methyl-2-pyridinyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 129012674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).