3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole

C16H11N5O — CID 53171773

IUPAC3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole
SMILESc1ccc(-c2nc(-c3ccc(-n4ccnc4)nc3)no2)cc1
InChIInChI=1S/C16H11N5O/c1-2-4-12(5-3-1)16-19-15(20-22-16)13-6-7-14(18-10-13)21-9-8-17-11-21/h1-11H
InChIKeyRDWBSTVMXAAABM-UHFFFAOYSA-N
MW289.30 g/mol
LogP2.98
Rot. Bonds3

About 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole

3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole (PubChem CID 53171773) has the molecular formula C16H11N5O and a molecular weight of 289.30 g/mol. Its IUPAC name is 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole
PubChem CID53171773
Molecular FormulaC16H11N5O
Molecular Weight289.30 g/mol
Exact Mass289.10
IUPAC Name3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole
SMILESc1ccc(-c2nc(-c3ccc(-n4ccnc4)nc3)no2)cc1
InChIInChI=1S/C16H11N5O/c1-2-4-12(5-3-1)16-19-15(20-22-16)13-6-7-14(18-10-13)21-9-8-17-11-21/h1-11H
InChIKeyRDWBSTVMXAAABM-UHFFFAOYSA-N
XLogP2.98
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.30
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole?
The IUPAC name of 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole (CID 53171773) is 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole.
What is the SMILES notation for 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole?
The canonical SMILES for 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole is c1ccc(-c2nc(-c3ccc(-n4ccnc4)nc3)no2)cc1.
What is the InChIKey of 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole?
The InChIKey is RDWBSTVMXAAABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N5O/c1-2-4-12(5-3-1)16-19-15(20-22-16)13-6-7-14(18-10-13)21-9-8-17-11-21/h1-11H.
What are the key properties of 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole?
3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole has a molecular weight of 289.30 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-imidazol-1-yl-3-pyridinyl)-5-phenyl-1,2,4-oxadiazole is sourced from PubChem (CID 53171773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).