5-pyridin-4-yl-1,3-thiazolidine

C8H10N2S — CID 174411310

IUPAC5-pyridin-4-yl-1,3-thiazolidine
SMILESc1cc(C2CNCS2)ccn1
InChIInChI=1S/C8H10N2S/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1-4,8,10H,5-6H2
InChIKeyUOLBYWXABIKPJN-UHFFFAOYSA-N
MW166.25 g/mol
LogP1.42
Rot. Bonds1

About 5-pyridin-4-yl-1,3-thiazolidine

5-pyridin-4-yl-1,3-thiazolidine (PubChem CID 174411310) has the molecular formula C8H10N2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 5-pyridin-4-yl-1,3-thiazolidine.

Molecular Properties

Compound Name5-pyridin-4-yl-1,3-thiazolidine
PubChem CID174411310
Molecular FormulaC8H10N2S
Molecular Weight166.25 g/mol
Exact Mass166.06
IUPAC Name5-pyridin-4-yl-1,3-thiazolidine
SMILESc1cc(C2CNCS2)ccn1
InChIInChI=1S/C8H10N2S/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1-4,8,10H,5-6H2
InChIKeyUOLBYWXABIKPJN-UHFFFAOYSA-N
XLogP1.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-4-yl-1,3-thiazolidine?
The IUPAC name of 5-pyridin-4-yl-1,3-thiazolidine (CID 174411310) is 5-pyridin-4-yl-1,3-thiazolidine.
What is the SMILES notation for 5-pyridin-4-yl-1,3-thiazolidine?
The canonical SMILES for 5-pyridin-4-yl-1,3-thiazolidine is c1cc(C2CNCS2)ccn1.
What is the InChIKey of 5-pyridin-4-yl-1,3-thiazolidine?
The InChIKey is UOLBYWXABIKPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2S/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1-4,8,10H,5-6H2.
What are the key properties of 5-pyridin-4-yl-1,3-thiazolidine?
5-pyridin-4-yl-1,3-thiazolidine has a molecular weight of 166.25 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-4-yl-1,3-thiazolidine is sourced from PubChem (CID 174411310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).