Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(=C(C(=O)NN)c2ccccc2)CC1- InChIKey
YSQHFYZJUYPJOD-UHFFFAOYSA-N- Molecular formula
- C18H25N3O3
- Average molar mass
- 331.4 g/mol
Names & identifiers
- Preferred name
- 4-(1-Phenyl-1-hydrazinocarbonyl-methylene)piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl 4-(2-hydrazinyl-2-oxo-1-phenylethylidene)piperidine-1-carboxylate
Names & synonyms
SCHEMBL1472667YSQHFYZJUYPJOD-UHFFFAOYSA-N4-(1-Phenyl-1-hydrazinocarbonyl-methylene)piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 11616910
- Nikkaji
- J2.265.855G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 492
Related reactions
5 records
Compound notes
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