[4-[4-(1-azabicyclo[2.2.2]octane-3-carbonylamino)phenyl]phenyl]methyl N-ethylcarbamate

HCID 21883460
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Basic information

Standard SMILES
CCNC(=O)OCc1ccc(-c2ccc(NC(=O)C3CN4CCC3CC4)cc2)cc1
InChIKey
GBDSFIOOBFJGPJ-UHFFFAOYSA-N
Molecular formula
C24H29N3O3
Average molar mass
407.5 g/mol
Monoisotopic mass
407.2208918

Names & identifiers

Preferred name
[4-[4-(1-azabicyclo[2.2.2]octane-3-carbonylamino)phenyl]phenyl]methyl N-ethylcarbamate
IUPAC
[4-[4-(1-azabicyclo[2.2.2]octane-3-carbonylamino)phenyl]phenyl]methyl N-ethylcarbamate

Database identifiers

PubChem CID
21883460

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
70.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
30

Related reactions

1 records
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Compound notes

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