2-Chloro-3-imidazol-1-ylpropanamide
Basic information
- CAS
65991-94-8- Standard SMILES
NC(=O)C(Cl)Cn1ccnc1- InChIKey
SRKNCZWSAGOLGR-UHFFFAOYSA-N- Molecular formula
- C6H8ClN3O
- Average molar mass
- 173.6 g/mol
- Monoisotopic mass
- 173.0355896
Names & identifiers
- Preferred name
- 2-Chloro-3-imidazol-1-ylpropanamide
- IUPAC
- 2-chloro-3-imidazol-1-ylpropanamide
Names & synonyms
2-chloro-3-imidazol-1-ylpropanamide65991-94-8NSC303296DTXSID603164172-Chloro-3-imidazol-1-yl-propanamideNSC-3032962-Chloro-3-(1H-imidazol-1-yl)propanamideDS-013111
Database identifiers
- CAS
65991-94-8- PubChem CID
- 327586
- DTXSID
DTXSID60316417
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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