Ketone, 1-(2-(dimethylamino)propyl)pyrrol-2-yl o-methoxyphenyl, hydrochloride

HCID 26680

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Basic information

CAS: 14415-62-4
Standard SMILES: COc1ccccc1C(=O)c1cccn1CC(C)[NH+](C)C.[Cl-]
InChIKey: SZHRVVQHCGPKOF-UHFFFAOYSA-N
Molecular formula: C17H23ClN2O2
Average molar mass: 322.8 g/mol
Monoisotopic mass: 322.1448057

Names & identifiers

Preferred name: Ketone, 1-(2-(dimethylamino)propyl)pyrrol-2-yl o-methoxyphenyl, hydrochloride
IUPAC: 1-[2-(2-methoxybenzoyl)pyrrol-1-yl]propan-2-yl-dimethylazanium chloride

Names & synonyms

1-(2-(Dimethylamino)propyl)-2-(o-methoxybenzoyl)pyrrole monohydrochlorideKETONE, 1-(2-(DIMETHYLAMINO)PROPYL)PYRROL-2-YL o-METHOXYPHENYL, HYDROCHLORIDE14415-62-4RefChem:350376

Database identifiers

CAS: 14415-62-4
PubChem CID: 26680

Properties

Computed structural properties

Topological polar surface area: 35.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 22
Formal charge: 0
Complexity: 346

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