5-(3-Fluoro-4-methylphenyl)-1,3,4-oxadiazole-2-ethanamine
Basic information
- CAS
1249222-78-3- Standard SMILES
Cc1ccc(-c2nnc(CCN)o2)cc1F- InChIKey
KCIACCSYXNSOIV-UHFFFAOYSA-N- Molecular formula
- C11H12FN3O
- Average molar mass
- 221.23 g/mol
- Monoisotopic mass
- 221.09644018
Names & identifiers
- Preferred name
- 5-(3-Fluoro-4-methylphenyl)-1,3,4-oxadiazole-2-ethanamine
- IUPAC
- 2-[5-(3-fluoro-4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethanamine
Names & synonyms
DTXSID601195046AKOS0113478065-(3-Fluoro-4-methylphenyl)-1,3,4-oxadiazole-2-ethanamine2-[5-(3-Fluoro-4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethan-1-amine1249222-78-3
Database identifiers
- CAS
1249222-78-3- PubChem CID
- 62069712
- DTXSID
DTXSID601195046
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 229
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…