2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol

C11H15NO2S — CID 66218899

IUPAC2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol
SMILESCOc1ccc(C2NC(C)CS2)cc1O
InChIInChI=1S/C11H15NO2S/c1-7-6-15-11(12-7)8-3-4-10(14-2)9(13)5-8/h3-5,7,11-13H,6H2,1-2H3
InChIKeyOERUMRIAVQWVNR-UHFFFAOYSA-N
MW225.31 g/mol
LogP2.12
Rot. Bonds2

About 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol

2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol (PubChem CID 66218899) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol.

Molecular Properties

Compound Name2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol
PubChem CID66218899
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol
SMILESCOc1ccc(C2NC(C)CS2)cc1O
InChIInChI=1S/C11H15NO2S/c1-7-6-15-11(12-7)8-3-4-10(14-2)9(13)5-8/h3-5,7,11-13H,6H2,1-2H3
InChIKeyOERUMRIAVQWVNR-UHFFFAOYSA-N
XLogP2.12
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol?
The IUPAC name of 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol (CID 66218899) is 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol.
What is the SMILES notation for 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol?
The canonical SMILES for 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol is COc1ccc(C2NC(C)CS2)cc1O.
What is the InChIKey of 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol?
The InChIKey is OERUMRIAVQWVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-7-6-15-11(12-7)8-3-4-10(14-2)9(13)5-8/h3-5,7,11-13H,6H2,1-2H3.
What are the key properties of 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol?
2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol has a molecular weight of 225.31 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-(4-methyl-1,3-thiazolidin-2-yl)phenol is sourced from PubChem (CID 66218899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).