1,3-Benzodioxole-2-acetamide, N-(2-diethylaminoethyl)-2-phenyl-, monohydrochloride

HCID 48844

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Basic information

CAS: 67011-37-4
Standard SMILES: CCN(CC)CCNC(=O)CC1(c2ccccc2)Oc2ccccc2O1.Cl
InChIKey: OBTYMKNUXLCRKU-UHFFFAOYSA-N
Molecular formula: C21H27ClN2O3
Average molar mass: 390.9 g/mol
Monoisotopic mass: 390.1710204

Names & identifiers

Preferred name: 1,3-Benzodioxole-2-acetamide, N-(2-diethylaminoethyl)-2-phenyl-, monohydrochloride
IUPAC: N-[2-(diethylamino)ethyl]-2-(2-phenyl-1,3-benzodioxol-2-yl)acetamide;hydrochloride
English name: N-(2-Diethylaminoethyl)-2-phenyl-1,3-benzodioxole-2-acetamide
Molecular formula: C21H26N2O3
Molecular weight: 354.44

Names & synonyms

1,3-Benzodioxole-2-acetamide, N-(2-diethylaminoethyl)-2-phenyl-, monohydrochloride67011-37-4DTXSID80217210N-(2-Diethylaminoethyl)-2-phenyl-1,3-benzodioxole-2-acetamide monohydrochlorideRefChem:217900DTXCID80139701N-[2-(Diethylamino)ethyl]-2-(2-phenyl-2H-1,3-benzodioxol-2-yl)acetamide--hydrogen chloride (1/1)N-(2-Diethylaminoethyl)-2-phenyl-1,3-benzodioxole-2-acetamide1,3-Benzodioxole-2-acetamide, N-[2-(diethylamino)ethyl]-2-phenyl-

Database identifiers

CAS: 67011-37-4
PubChem CID: 48844
DTXSID: DTXSID80217210

Properties

Computed structural properties

Topological polar surface area: 50.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 8
Heavy atoms: 27
Formal charge: 0
Complexity: 433

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