1-Oxa-3,8-diazaspiro(4.5)decan-2-one, 8-(3,4-(methylenedioxy)phenethyl)-

HCID 199892

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Basic information

CAS: 5229-89-0
Standard SMILES: O=C1NCC2(CCN(CCc3ccc4c(c3)OCO4)CC2)O1
InChIKey: XJQGDOIUPCXNJO-UHFFFAOYSA-N
Molecular formula: C16H20N2O4
Average molar mass: 304.34 g/mol
Monoisotopic mass: 304.14230712

Names & identifiers

Preferred name: 1-Oxa-3,8-diazaspiro(4.5)decan-2-one, 8-(3,4-(methylenedioxy)phenethyl)-
IUPAC: 8-[2-(1,3-benzodioxol-5-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
English name: 8-[3,4-(Methylenebisoxy)phenethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Molecular formula: C16H20N2O4
Molecular weight: 304.34

Names & synonyms

BRN 05595125229-89-01-Oxa-3,8-diazaspiro(4.5)decan-2-one, 8-(3,4-(methylenedioxy)phenethyl)-DTXSID102003128-(3,4-(Methylenedioxy)phenethyl)-1-oxa-3,8-diazaspiro(4.5)decan-2-oneRefChem:232647DTXCID101228038-[2-(2H-1,3-benzodioxol-5-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one8-[3,4-(Methylenebisoxy)phenethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one1-Oxa-3,8-diazaspiro[4.5]decan-2-one, 8-[2-(1,3-benzodioxol-5-yl)ethyl]-

Database identifiers

CAS: 5229-89-0
PubChem CID: 199892
DTXSID: DTXSID10200312
Nikkaji: J42.553B

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 60 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 22
Formal charge: 0
Complexity: 422

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