2-phenyl-1,3-thiazolidin-2-ol

C9H11NOS — CID 54292280

IUPAC2-phenyl-1,3-thiazolidin-2-ol
SMILESOC1(c2ccccc2)NCCS1
InChIInChI=1S/C9H11NOS/c11-9(10-6-7-12-9)8-4-2-1-3-5-8/h1-5,10-11H,6-7H2
InChIKeyRYIVRLWJRCHUCL-UHFFFAOYSA-N
MW181.26 g/mol
LogP1.13
Rot. Bonds1

About 2-phenyl-1,3-thiazolidin-2-ol

2-phenyl-1,3-thiazolidin-2-ol (PubChem CID 54292280) has the molecular formula C9H11NOS and a molecular weight of 181.26 g/mol. Its IUPAC name is 2-phenyl-1,3-thiazolidin-2-ol.

Molecular Properties

Compound Name2-phenyl-1,3-thiazolidin-2-ol
PubChem CID54292280
Molecular FormulaC9H11NOS
Molecular Weight181.26 g/mol
Exact Mass181.06
IUPAC Name2-phenyl-1,3-thiazolidin-2-ol
SMILESOC1(c2ccccc2)NCCS1
InChIInChI=1S/C9H11NOS/c11-9(10-6-7-12-9)8-4-2-1-3-5-8/h1-5,10-11H,6-7H2
InChIKeyRYIVRLWJRCHUCL-UHFFFAOYSA-N
XLogP1.13
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1,3-thiazolidin-2-ol?
The IUPAC name of 2-phenyl-1,3-thiazolidin-2-ol (CID 54292280) is 2-phenyl-1,3-thiazolidin-2-ol.
What is the SMILES notation for 2-phenyl-1,3-thiazolidin-2-ol?
The canonical SMILES for 2-phenyl-1,3-thiazolidin-2-ol is OC1(c2ccccc2)NCCS1.
What is the InChIKey of 2-phenyl-1,3-thiazolidin-2-ol?
The InChIKey is RYIVRLWJRCHUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NOS/c11-9(10-6-7-12-9)8-4-2-1-3-5-8/h1-5,10-11H,6-7H2.
What are the key properties of 2-phenyl-1,3-thiazolidin-2-ol?
2-phenyl-1,3-thiazolidin-2-ol has a molecular weight of 181.26 g/mol, XLogP of 1.13, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1,3-thiazolidin-2-ol is sourced from PubChem (CID 54292280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).