Basic information
- Standard SMILES
CC(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1- InChIKey
CMRZORJJWUFSBW-UHFFFAOYSA-N- Molecular formula
- C13H17N3O3
- Average molar mass
- 263.29 g/mol
Names & identifiers
- Preferred name
- N-(1-(4-nitrophenyl)piperidin-4-yl)acetamide
- IUPAC
- N-[1-(4-nitrophenyl)piperidin-4-yl]acetamide
Names & synonyms
N-(1-(4-nitrophenyl)piperidin-4-yl)acetamide1415793-96-2SCHEMBL14167741CMRZORJJWUFSBW-UHFFFAOYSA-NDA-45185
Database identifiers
- PubChem CID
- 49431107
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 78.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 327
Related reactions
2 records
Compound notes
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