1,1-Cyclopentanediacetimide, N-(4-(4-(o-nitrophenyl)-1-piperazinyl)butyl)-, monohydrochloride
Basic information
- CAS
25024-80-0- Standard SMILES
Cl.O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ccccc2[N+](=O)[O-])CC1- InChIKey
UFAAYAAQUHKMPO-UHFFFAOYSA-N- Molecular formula
- C23H33ClN4O4
- Average molar mass
- 465 g/mol
- Monoisotopic mass
- 464.2190332
Names & identifiers
- Preferred name
- 1,1-Cyclopentanediacetimide, N-(4-(4-(o-nitrophenyl)-1-piperazinyl)butyl)-, monohydrochloride
- IUPAC
- 8-[4-[4-(2-nitrophenyl)piperazin-1-yl]butyl]-8-azaspiro[4.5]decane-7,9-dione;hydrochloride
Names & synonyms
25024-80-01,1-Cyclopentanediacetimide, N-(4-(4-(o-nitrophenyl)-1-piperazinyl)butyl)-, monohydrochlorideN-(4-(4-(o-Nitrophenyl)-1-piperazinyl)butyl)-1,1-cyclopentanediacetimide hydrochlorideDTXSID90179734RefChem:213472DTXCID501022258-{4-[4-(2-Nitrophenyl)piperazin-1-yl]butyl}-8-azaspiro[4.5]decane-7,9-dione--hydrogen chloride (1/1)
Database identifiers
- CAS
25024-80-0- PubChem CID
- 212828
- DTXSID
DTXSID90179734
Properties
Computed structural properties
- Topological polar surface area
- 89.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 645
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Related reactions
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Compound notes
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