Basic information
- CAS
27771-21-7- Standard SMILES
CN1C(c2ccccc2)CC(=NO)CC1c1ccccc1- InChIKey
PBJCHMDKVHLZPM-UHFFFAOYSA-N- Molecular formula
- C18H20N2O
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.15756327
Names & identifiers
- Preferred name
- N-(1-methyl-2,6-diphenylpiperidin-4-ylidene)hydroxylamine
- IUPAC
- N-(1-methyl-2,6-diphenylpiperidin-4-ylidene)hydroxylamine
Names & synonyms
27771-21-7N-(1-methyl-2,6-diphenylpiperidin-4-ylidene)hydroxylamine1-methyl-2,6-diphenyl-4-piperidinone oximeNSC132834CBMicro_029238Oprea1_778158MLS001163491CHEMBL1405762DTXSID60950456HMS2829K04NSC-132834SMR000496765
Show more names
BIM-0029432.P001(+)-1-methyl-2,6-diphenyl-4-piperidone oximeAB00097621-01SR-01000220577SR-01000220577-1
Database identifiers
- CAS
27771-21-7- PubChem CID
- 280709
- DTXSID
DTXSID60950456- ChEMBL
CHEMBL1405762
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 326
Experimental & physicochemical properties
Solubility1.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…