5-methyl-2-(4-methylphenyl)-1,3-thiazolidine

C11H15NS — CID 3087740

IUPAC5-methyl-2-(4-methylphenyl)-1,3-thiazolidine
SMILESCc1ccc(C2NCC(C)S2)cc1
InChIInChI=1S/C11H15NS/c1-8-3-5-10(6-4-8)11-12-7-9(2)13-11/h3-6,9,11-12H,7H2,1-2H3
InChIKeyMNOWSQVEFSDPEU-UHFFFAOYSA-N
MW193.31 g/mol
LogP2.72
Rot. Bonds1

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

5-methyl-2-(4-methylphenyl)-1,3-thiazolidine (PubChem CID 3087740) has the molecular formula C11H15NS and a molecular weight of 193.31 g/mol. Its IUPAC name is 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine.

Molecular Properties

Compound Name5-methyl-2-(4-methylphenyl)-1,3-thiazolidine
PubChem CID3087740
Molecular FormulaC11H15NS
Molecular Weight193.31 g/mol
Exact Mass193.09
IUPAC Name5-methyl-2-(4-methylphenyl)-1,3-thiazolidine
SMILESCc1ccc(C2NCC(C)S2)cc1
InChIInChI=1S/C11H15NS/c1-8-3-5-10(6-4-8)11-12-7-9(2)13-11/h3-6,9,11-12H,7H2,1-2H3
InChIKeyMNOWSQVEFSDPEU-UHFFFAOYSA-N
XLogP2.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine?
The IUPAC name of 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine (CID 3087740) is 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine.
What is the SMILES notation for 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine?
The canonical SMILES for 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine is Cc1ccc(C2NCC(C)S2)cc1.
What is the InChIKey of 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine?
The InChIKey is MNOWSQVEFSDPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NS/c1-8-3-5-10(6-4-8)11-12-7-9(2)13-11/h3-6,9,11-12H,7H2,1-2H3.
What are the key properties of 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine?
5-methyl-2-(4-methylphenyl)-1,3-thiazolidine has a molecular weight of 193.31 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-methylphenyl)-1,3-thiazolidine is sourced from PubChem (CID 3087740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).