Basic information
- Standard SMILES
O=C(Nc1ccccc1[N+](=O)[O-])OCC1CCN(c2ccncc2)CC1- InChIKey
GULCVFPRVNXPLI-UHFFFAOYSA-N- Molecular formula
- C18H20N4O4
- Average molar mass
- 356.4 g/mol
Names & identifiers
- Preferred name
- 2-Nitro-N-[[1-(4-pyridyl)piperidin-4-yl]methoxycarbonyl]aniline
- IUPAC
- (1-pyridin-4-ylpiperidin-4-yl)methyl N-(2-nitrophenyl)carbamate
Names & synonyms
SCHEMBL5221853GULCVFPRVNXPLI-UHFFFAOYSA-N2-nitro-n-[[1-(4-pyridyl)piperidin-4-yl]methoxy-carbonyl]aniline2-Nitro-N-[[1-(4-pyridyl)piperidin-4-yl]methoxycarbonyl]aniline2-nitro-N-[1-(4-pyridyl)piperidin-4-yl-methoxycarbonyl)benzeneamine
Database identifiers
- PubChem CID
- 18174618
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 470
Related reactions
5 records
Compound notes
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