3-fluoro-N-[3-(1H-imidazol-1-yl)propyl]benzamide
Basic information
- CAS
93669-27-3- Standard SMILES
O=C(NCCCn1ccnc1)c1cccc(F)c1- InChIKey
HRLUVMKWVSMDCV-UHFFFAOYSA-N- Molecular formula
- C13H14FN3O
- Average molar mass
- 247.27 g/mol
- Monoisotopic mass
- 247.11209024
Names & identifiers
- Preferred name
- 3-fluoro-N-[3-(1H-imidazol-1-yl)propyl]benzamide
- IUPAC
- 3-fluoro-N-(3-imidazol-1-ylpropyl)benzamide
Names & synonyms
3-fluoro-N-[3-(1H-imidazol-1-yl)propyl]benzamide93669-27-3CHEMBL345995DTXSID301235964AKOS001081381ST45147603AK-968/12117302(3-fluorophenyl)-N-(3-imidazolylpropyl)carboxamideZ31795853
Database identifiers
- CAS
93669-27-3- PubChem CID
- 4083237
- DTXSID
DTXSID301235964- ChEMBL
CHEMBL345995
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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