Ketone, 1-(2-(dimethylamino)ethyl)pyrrol-2-yl p-fluorophenyl, hydrochloride

HCID 26971

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Basic information

CAS: 14927-35-6
Standard SMILES: C[NH+](C)CCn1cccc1C(=O)c1ccc(F)cc1.[Cl-]
InChIKey: KDMJXOIPHXOXOV-UHFFFAOYSA-N
Molecular formula: C15H18ClFN2O
Average molar mass: 296.77 g/mol
Monoisotopic mass: 296.1091691

Names & identifiers

Preferred name: Ketone, 1-(2-(dimethylamino)ethyl)pyrrol-2-yl p-fluorophenyl, hydrochloride
IUPAC: 2-[2-(4-fluorobenzoyl)pyrrol-1-yl]ethyl-dimethylazanium chloride

Names & synonyms

1-(2-(Dimethylamino)ethyl)-2-(p-fluorobenzoyl)pyrrole monohydrochloride14927-35-6KETONE, 1-(2-(DIMETHYLAMINO)ETHYL)PYRROL-2-YL p-FLUOROPHENYL, HYDROCHLORIDERefChem:350374

Database identifiers

CAS: 14927-35-6
PubChem CID: 26971

Properties

Computed structural properties

Topological polar surface area: 26.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 20
Formal charge: 0
Complexity: 301

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