2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one

C15H14N2OS — CID 3863359

IUPAC2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccccc2)N1Cc1ccccn1
InChIInChI=1S/C15H14N2OS/c18-14-11-19-15(12-6-2-1-3-7-12)17(14)10-13-8-4-5-9-16-13/h1-9,15H,10-11H2
InChIKeyOUFWVMWVSGJVGV-UHFFFAOYSA-N
MW270.36 g/mol
LogP2.86
Rot. Bonds3

About 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one

2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one (PubChem CID 3863359) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one
PubChem CID3863359
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccccc2)N1Cc1ccccn1
InChIInChI=1S/C15H14N2OS/c18-14-11-19-15(12-6-2-1-3-7-12)17(14)10-13-8-4-5-9-16-13/h1-9,15H,10-11H2
InChIKeyOUFWVMWVSGJVGV-UHFFFAOYSA-N
XLogP2.86
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one (CID 3863359) is 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one is O=C1CSC(c2ccccc2)N1Cc1ccccn1.
What is the InChIKey of 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one?
The InChIKey is OUFWVMWVSGJVGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c18-14-11-19-15(12-6-2-1-3-7-12)17(14)10-13-8-4-5-9-16-13/h1-9,15H,10-11H2.
What are the key properties of 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one?
2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one has a molecular weight of 270.36 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-(pyridin-2-ylmethyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 3863359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).