delta(sup 4)-1,2,4-Oxadiazoline, 5-(2-(diethylamino)ethyl)-3-(p-methoxyphenyl)-, hydrochloride

HCID 59404

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Basic information

CAS: 102504-35-8
Standard SMILES: CCN(CC)CCC1=NNC(c2ccc(OC)cc2)O1.[Cl-]
InChIKey: JUWIUBMQFHTVOM-UHFFFAOYSA-M
Molecular formula: C15H23ClN3O2-
Average molar mass: 312.81 g/mol
Monoisotopic mass: 312.1478797

Names & identifiers

Preferred name: delta(sup 4)-1,2,4-Oxadiazoline, 5-(2-(diethylamino)ethyl)-3-(p-methoxyphenyl)-, hydrochloride
IUPAC: N,N-diethyl-2-[2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-oxadiazol-5-yl]ethanamine chloride

Names & synonyms

102504-35-8delta(sup 4)-1,2,4-Oxadiazoline, 5-(2-(diethylamino)ethyl)-3-(p-methoxyphenyl)-, hydrochlorideRefChem:1083112N,N-diethyl-2-[2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-oxadiazol-5-yl]ethanamine;chloride

Database identifiers

CAS: 102504-35-8
PubChem CID: 59404

Properties

Computed structural properties

Topological polar surface area: 46.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 7
Heavy atoms: 21
Formal charge: -1
Complexity: 310

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