N-(2-(diethylamino)ethyl)-4-nitrosobenzamide
Basic information
- CAS
95576-28-6- Standard SMILES
CCN(CC)CCNC(=O)c1ccc(N=O)cc1- InChIKey
HVBDBNBRWGIRLT-UHFFFAOYSA-N- Molecular formula
- C13H19N3O2
- Average molar mass
- 249.31 g/mol
- Monoisotopic mass
- 249.14772686
Overview
4-nitrosoprocainamide is a benzamide obtained via formal condensation of 4-nitrosobenzoic acid and 2-(diethylamino)ethylamine. It is a member of benzamides and a nitroso compound.
Names & identifiers
- Preferred name
- N-(2-(diethylamino)ethyl)-4-nitrosobenzamide
- IUPAC
- N-[2-(diethylamino)ethyl]-4-nitrosobenzamide
- English name
- 4-nitrosoprocainamide
- Molecular formula
- C13H19N3O2
- Molecular weight
- 249.30886
Names & synonyms
4-NitrosoprocainamideN-[2-(diethylamino)ethyl]-4-nitrosobenzamide95576-28-6CHEBI:60729DTXSID10241886N-(2-(Diethylamino)ethyl)-4-nitrosobenzamideRefChem:100165DTXCID40164377nitrosoprocainamideNOPAEpitope ID:140120SCHEMBL29351154
Show more names
HVBDBNBRWGIRLT-UHFFFAOYSA-NQ27128567
Database identifiers
- CAS
95576-28-6- PubChem CID
- 125601
- DTXSID
DTXSID10241886- ChEBI
CHEBI:60729- Nikkaji
- J401.202J
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 259
Chemistry & industry
Additional notes
DefinitionChEBI: A benzamide obtained via formal condensation of 4-nitrosobenzoic acid and 2-(diethylamino)ethylamine.
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Related reactions
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