Basic information
- Standard SMILES
Nc1cccc(-c2nnc(-c3ccccc3)o2)c1- InChIKey
DOYLAQBXDHFRFB-UHFFFAOYSA-N- Molecular formula
- C14H11N3O
- Average molar mass
- 237.26 g/mol
Names & identifiers
- Preferred name
- 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline
- IUPAC
- 3-(5-phenyl-1,3,4-oxadiazol-2-yl)aniline
Names & synonyms
3-(5-phenyl-1,3,4-oxadiazol-2-yl)aniline107559-05-7CBMicro_029783Cambridge id 5740854SCHEMBL653811CHEMBL3687968BDBM47366DOYLAQBXDHFRFB-UHFFFAOYSA-NUS9034574, XXIIISTK520522AKOS005454824BIM-0029951.P001
Show more names
3-(2-phenyl-1,3,4-oxadiazol-5-yl)aniline
Database identifiers
- PubChem CID
- 818367
- ChEMBL
CHEMBL3687968
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 268
Related reactions
24 records
Compound notes
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