N-Phenylcarbamic Acid (3S)-1-azabicyclo[2.2.2]octan-3-yl Ester

HCID 684226
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Basic information

Standard SMILES
O=C(Nc1ccccc1)O[C@@H]1CN2CCC1CC2
InChIKey
JEPJAGMRBZWMCT-CYBMUJFWSA-N
Molecular formula
C14H18N2O2
Average molar mass
246.3 g/mol

Names & identifiers

Preferred name
N-Phenylcarbamic Acid (3S)-1-azabicyclo[2.2.2]octan-3-yl Ester
IUPAC
[(3S)-1-azabicyclo[2.2.2]octan-3-yl] N-phenylcarbamate

Names & synonyms

SCHEMBL372949JEPJAGMRBZWMCT-CYBMUJFWSA-NN-Phenylcarbamic Acid (3S)-1-azabicyclo[2.2.2]octan-3-yl Ester

Database identifiers

PubChem CID
684226

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
41.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
18

Related reactions

1 records
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Compound notes

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