1-(Diethylamino)-3H-pyrrolizin-3-one

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Basic information

CAS: 944-74-1
Standard SMILES: CCN(CC)C1=CC(=O)n2cccc21
InChIKey: OAPBNMOWKFMKIS-UHFFFAOYSA-N
Molecular formula: C11H14N2O
Average molar mass: 190.24 g/mol
Monoisotopic mass: 190.11061307

Names & identifiers

Preferred name: 1-(Diethylamino)-3H-pyrrolizin-3-one
IUPAC: 1-(diethylamino)pyrrolizin-3-one

Names & synonyms

1-(Diethylamino)-3H-pyrrolizin-3-one1-(diethylamino)pyrrolizin-3-one944-74-1DB5LT69JPUNSC 872471-diethylamino-pyrrolizin-3-oneNSC-87247DTXSID102414673H-PYRROLIZIN-3-ONE, 1-(DIETHYLAMINO)-RefChem:74675DTXCID10163958NSC87247

Show more names

UNII-DB5LT69JPU

Database identifiers

CAS: 944-74-1
PubChem CID: 258388
DTXSID: DTXSID10241467
UNII: DB5LT69JPU

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 25.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 14
Formal charge: 0
Complexity: 268

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Compound notes

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