Basic information
- CAS
5227-91-8- Standard SMILES
CN(O)CCCN1c2ccccc2CCc2ccccc21- InChIKey
NLQAJTWNLBARHZ-UHFFFAOYSA-N- Molecular formula
- C18H22N2O
- Average molar mass
- 282.4 g/mol
- Monoisotopic mass
- 282.17321333
Overview
RN given refers to cpd with specified hydroxy locant; structure given in first source
Names & identifiers
- Preferred name
- N-Hydroxydesipramine
- IUPAC
- N-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-N-methylhydroxylamine
- English name
- N-hydroxydesipramine
- Molecular formula
- C18H22N2O
- Molecular weight
- 282.38
Names & synonyms
N-HydroxydesmethylimipramineN-Hydroxydesipramine5227-91-8RefChem:163539N-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-N-methylhydroxylamineDTXSID709666445H-Dibenz(b,f)azepine-5-propanamine, 10,11-dihydro-N-hydroxy-N-methyl-3-(10,11-Dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-hydroxy-N-methylpropan-1-amine5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N-hydroxy-N-methyl-
Database identifiers
- CAS
5227-91-8- PubChem CID
- 30989
- DTXSID
DTXSID70966644
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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