4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine

C9H13NOS — CID 66217186

IUPAC4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine
SMILESCc1ccc(C2NC(C)CS2)o1
InChIInChI=1S/C9H13NOS/c1-6-5-12-9(10-6)8-4-3-7(2)11-8/h3-4,6,9-10H,5H2,1-2H3
InChIKeyVEKGGFRIGQCGSF-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.31
Rot. Bonds1

About 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine

4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine (PubChem CID 66217186) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine.

Molecular Properties

Compound Name4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine
PubChem CID66217186
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine
SMILESCc1ccc(C2NC(C)CS2)o1
InChIInChI=1S/C9H13NOS/c1-6-5-12-9(10-6)8-4-3-7(2)11-8/h3-4,6,9-10H,5H2,1-2H3
InChIKeyVEKGGFRIGQCGSF-UHFFFAOYSA-N
XLogP2.31
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine?
The IUPAC name of 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine (CID 66217186) is 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine.
What is the SMILES notation for 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine?
The canonical SMILES for 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine is Cc1ccc(C2NC(C)CS2)o1.
What is the InChIKey of 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine?
The InChIKey is VEKGGFRIGQCGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-6-5-12-9(10-6)8-4-3-7(2)11-8/h3-4,6,9-10H,5H2,1-2H3.
What are the key properties of 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine?
4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine has a molecular weight of 183.28 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazolidine is sourced from PubChem (CID 66217186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).