3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one

C13H18N2O2S2 — CID 3682436

IUPAC3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccsc2)N1CCN1CCOCC1
InChIInChI=1S/C13H18N2O2S2/c16-12-10-19-13(11-1-8-18-9-11)15(12)3-2-14-4-6-17-7-5-14/h1,8-9,13H,2-7,10H2
InChIKeyCPSQSLJYTDCIMA-UHFFFAOYSA-N
MW298.43 g/mol
LogP1.65
Rot. Bonds4

About 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one

3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one (PubChem CID 3682436) has the molecular formula C13H18N2O2S2 and a molecular weight of 298.43 g/mol. Its IUPAC name is 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one
PubChem CID3682436
Molecular FormulaC13H18N2O2S2
Molecular Weight298.43 g/mol
Exact Mass298.08
IUPAC Name3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccsc2)N1CCN1CCOCC1
InChIInChI=1S/C13H18N2O2S2/c16-12-10-19-13(11-1-8-18-9-11)15(12)3-2-14-4-6-17-7-5-14/h1,8-9,13H,2-7,10H2
InChIKeyCPSQSLJYTDCIMA-UHFFFAOYSA-N
XLogP1.65
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one (CID 3682436) is 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one is O=C1CSC(c2ccsc2)N1CCN1CCOCC1.
What is the InChIKey of 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one?
The InChIKey is CPSQSLJYTDCIMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2S2/c16-12-10-19-13(11-1-8-18-9-11)15(12)3-2-14-4-6-17-7-5-14/h1,8-9,13H,2-7,10H2.
What are the key properties of 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one?
3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one has a molecular weight of 298.43 g/mol, XLogP of 1.65, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-ylethyl)-2-thiophen-3-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 3682436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).