Basic information
- CAS
102504-31-4- Standard SMILES
Cc1nnc(Nc2cccc3ccccc23)o1- InChIKey
JDJIMBCRNDUTPF-UHFFFAOYSA-N- Molecular formula
- C13H11N3O
- Average molar mass
- 225.25 g/mol
- Monoisotopic mass
- 225.09021198
Names & identifiers
- Preferred name
- 1,3,4-Oxadiazole, 5-methyl-2-(1-naphthylamino)-
- IUPAC
- 5-methyl-N-naphthalen-1-yl-1,3,4-oxadiazol-2-amine
Names & synonyms
5-Methyl-2-(1-naphthylamino)-1,3,4-oxadiazole1,3,4-OXADIAZOLE, 5-METHYL-2-(1-NAPHTHYLAMINO)-2-(1-Naphthylamino)-5-methyl-1,3,4-oxadiazole102504-31-4DTXSID60145204RefChem:216924DTXCID90676955-methyl-n-(naphthalen-1-yl)-1,3,4-oxadiazol-2-amine
Database identifiers
- CAS
102504-31-4- PubChem CID
- 59397
- DTXSID
DTXSID60145204- Nikkaji
- J64.532J
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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