2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole

C17H17NO2Te — CID 135050813

IUPAC2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole
SMILESCC1=NC(c2ccccc2)C(C)([Te](=O)c2ccccc2)O1
InChIInChI=1S/C17H17NO2Te/c1-13-18-16(14-9-5-3-6-10-14)17(2,20-13)21(19)15-11-7-4-8-12-15/h3-12,16H,1-2H3
InChIKeyMUIQMUGZPDQSPG-UHFFFAOYSA-N
MW394.93 g/mol
LogP2.80
Rot. Bonds3

About 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole

2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole (PubChem CID 135050813) has the molecular formula C17H17NO2Te and a molecular weight of 394.93 g/mol. Its IUPAC name is 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole.

Molecular Properties

Compound Name2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole
PubChem CID135050813
Molecular FormulaC17H17NO2Te
Molecular Weight394.93 g/mol
Exact Mass397.03
IUPAC Name2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole
SMILESCC1=NC(c2ccccc2)C(C)([Te](=O)c2ccccc2)O1
InChIInChI=1S/C17H17NO2Te/c1-13-18-16(14-9-5-3-6-10-14)17(2,20-13)21(19)15-11-7-4-8-12-15/h3-12,16H,1-2H3
InChIKeyMUIQMUGZPDQSPG-UHFFFAOYSA-N
XLogP2.80
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.93
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole?
The IUPAC name of 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole (CID 135050813) is 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole.
What is the SMILES notation for 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole?
The canonical SMILES for 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole is CC1=NC(c2ccccc2)C(C)([Te](=O)c2ccccc2)O1.
What is the InChIKey of 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole?
The InChIKey is MUIQMUGZPDQSPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2Te/c1-13-18-16(14-9-5-3-6-10-14)17(2,20-13)21(19)15-11-7-4-8-12-15/h3-12,16H,1-2H3.
What are the key properties of 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole?
2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole has a molecular weight of 394.93 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-phenyl-5-phenyltellurinyl-4H-1,3-oxazole is sourced from PubChem (CID 135050813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).