2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole

C15H19N3OS — CID 134842486

IUPAC2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole
SMILESCC1(C)NC(c2nnc(-c3ccccc3)o2)C(C)(C)S1
InChIInChI=1S/C15H19N3OS/c1-14(2)11(16-15(3,4)20-14)13-18-17-12(19-13)10-8-6-5-7-9-10/h5-9,11,16H,1-4H3
InChIKeyUDONPYHBYKNUIQ-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.63
Rot. Bonds2

About 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole

2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole (PubChem CID 134842486) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole
PubChem CID134842486
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole
SMILESCC1(C)NC(c2nnc(-c3ccccc3)o2)C(C)(C)S1
InChIInChI=1S/C15H19N3OS/c1-14(2)11(16-15(3,4)20-14)13-18-17-12(19-13)10-8-6-5-7-9-10/h5-9,11,16H,1-4H3
InChIKeyUDONPYHBYKNUIQ-UHFFFAOYSA-N
XLogP3.63
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole (CID 134842486) is 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole is CC1(C)NC(c2nnc(-c3ccccc3)o2)C(C)(C)S1.
What is the InChIKey of 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole?
The InChIKey is UDONPYHBYKNUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-14(2)11(16-15(3,4)20-14)13-18-17-12(19-13)10-8-6-5-7-9-10/h5-9,11,16H,1-4H3.
What are the key properties of 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole?
2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole has a molecular weight of 289.40 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-(2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 134842486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).