N-(1,1-Dimethylethyl)-5-(4-nitrophenyl)-1H-imidazole-1-acetamide
Basic information
- CAS
361374-59-6- Standard SMILES
CC(C)(C)NC(=O)Cn1cncc1-c1ccc([N+](=O)[O-])cc1- InChIKey
MIPRSOHLMCSDMM-UHFFFAOYSA-N- Molecular formula
- C15H18N4O3
- Average molar mass
- 302.33 g/mol
- Monoisotopic mass
- 302.13789045
Names & identifiers
- Preferred name
- N-(1,1-Dimethylethyl)-5-(4-nitrophenyl)-1H-imidazole-1-acetamide
- IUPAC
- N-tert-butyl-2-[5-(4-nitrophenyl)imidazol-1-yl]acetamide
Names & synonyms
361374-59-6N-(1,1-Dimethylethyl)-5-(4-nitrophenyl)-1H-imidazole-1-acetamideRefChem:359792N-tert-butyl-2-[5-(4-nitrophenyl)imidazol-1-yl]acetamideOprea1_231482MIPRSOHLMCSDMM-UHFFFAOYSA-NDTXSID301172853N-tert-butyl-2-[5-(4-nitrophenyl)-1H-imidazol-1-yl]acetamideAKOS001739278ST4059574AG-205/14740075SR-01000531345
Show more names
SR-01000531345-1N-(tert-butyl)-2-(5-{4-nitrophenyl}-1H-imidazol-1-yl)acetamideN-(tert-Butyl)-2-[5-(4-nitrophenyl)-1H-imidazol-1-yl]acetamide #Acetamide, N-(1,1-dimethylethyl)-2-[5-(4-nitrophenyl)-1-imidazolyl]-
Database identifiers
- CAS
361374-59-6- PubChem CID
- 608911
- DTXSID
DTXSID301172853
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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