Basic information
- CAS
41711-12-0- Standard SMILES
CC(=O)Nc1cnc(-c2ncc([N+](=O)[O-])n2C)nc1- InChIKey
NFZLCVLYJLJSON-UHFFFAOYSA-N- Molecular formula
- C10H10N6O3
- Average molar mass
- 262.23 g/mol
- Monoisotopic mass
- 262.0814382
Names & identifiers
- Preferred name
- Acetamide, N-(2-(1-methyl-5-nitro-2-imidazolyl)-5-pyrimidinyl)-
- IUPAC
- N-[2-(1-methyl-5-nitroimidazol-2-yl)pyrimidin-5-yl]acetamide
Names & synonyms
41711-12-0ACETAMIDE, N-(2-(1-METHYL-5-NITRO-2-IMIDAZOLYL)-5-PYRIMIDINYL)-N-(2-(1-Methyl-5-nitro-2-imidazolyl)-5-pyrimidinyl)acetamideDTXSID20194511N-[2-(1-Methyl-5-nitro-1H-imidazol-2-yl)pyrimidin-5-yl]acetamide
Database identifiers
- CAS
41711-12-0- PubChem CID
- 38947
- DTXSID
DTXSID20194511
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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