4-Dimethylamino-3-nitro-1H-pyridin-2-one
Basic information
- CAS
923027-49-0- Standard SMILES
CN(C)c1cc[nH]c(=O)c1[N+](=O)[O-]- InChIKey
NUDLLTQAYQSUDY-UHFFFAOYSA-N- Molecular formula
- C7H9N3O3
- Average molar mass
- 183.16 g/mol
- Monoisotopic mass
- 183.06439116
Names & identifiers
- Preferred name
- 4-Dimethylamino-3-nitro-1H-pyridin-2-one
- IUPAC
- 4-(dimethylamino)-3-nitro-1H-pyridin-2-one
Names & synonyms
4-Dimethylamino-3-nitro-1H-pyridin-2-one923027-49-0SCHEMBL4166359DTXSID60727069NUDLLTQAYQSUDY-UHFFFAOYSA-N4-(Dimethylamino)-3-nitropyridin-2(1H)-one
Database identifiers
- CAS
923027-49-0- PubChem CID
- 57541449
- DTXSID
DTXSID60727069
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 78.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 311
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Compound notes
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