N-cyclohexyl-4,5-dimethoxy-2-nitrobenzamide
Basic information
- CAS
5867-30-1- Standard SMILES
COc1cc(C(=O)NC2CCCCC2)c([N+](=O)[O-])cc1OC- InChIKey
GQWSCTJNQYWSIB-UHFFFAOYSA-N- Molecular formula
- C15H20N2O5
- Average molar mass
- 308.33 g/mol
- Monoisotopic mass
- 308.13722174
Names & identifiers
- Preferred name
- N-cyclohexyl-4,5-dimethoxy-2-nitrobenzamide
- IUPAC
- N-cyclohexyl-4,5-dimethoxy-2-nitrobenzamide
Names & synonyms
N-cyclohexyl-4,5-dimethoxy-2-nitrobenzamideCambridge id 5867301Oprea1_044542DTXSID50974207STK071705AKOS001112296ST50713399AB00099768-01SR-01000222300SR-01000222300-1(4,5-dimethoxy-2-nitrophenyl)-N-cyclohexylcarboxamideN-Cyclohexyl-4,5-dimethoxy-2-nitrobenzene-1-carboximidic acid
Database identifiers
- CAS
5867-30-1- PubChem CID
- 876587
- DTXSID
DTXSID50974207
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 392
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Compound notes
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