Basic information
- Standard SMILES
CNc1ccc(Oc2ccnc(NC(=O)C3CCN(C)CC3)c2)cc1[N+](=O)[O-]- InChIKey
SJZIMXUTIXMWDF-UHFFFAOYSA-N- Molecular formula
- C19H23N5O4
- Average molar mass
- 385.4 g/mol
Names & identifiers
- Preferred name
- 1-methyl-N-(4-{[4-(methylamino)-3-nitrophenyl]oxy}pyridin-2-yl)piperidine-4-carboxamide
- IUPAC
- 1-methyl-N-[4-[4-(methylamino)-3-nitrophenoxy]-2-pyridinyl]piperidine-4-carboxamide
Names & synonyms
SCHEMBL4323749SJZIMXUTIXMWDF-UHFFFAOYSA-N1-methyl-N-(4-{[4-(methylamino)-3-nitrophenyl]oxy}-pyridin-2-yl)piperidine-4-carboxamide1-methyl-N-(4-{[4-(methylamino)-3-nitrophenyl]oxy}pyridin-2-yl)-piperidine-4-carboxamide1-methyl-N-(4-{[4-(methylamino)-3-nitrophenyl]oxy}pyridin-2-yl)piperidine-4-carboxamide
Database identifiers
- PubChem CID
- 69003266
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 535
Related reactions
5 records
Linked notes
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