4-methyl-phenyl-amino-phenyl-acetic acid (R)-(1-aza-bicyclo[2.2.2]oct-3-yl)ester

HCID 86643235
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Basic information

Standard SMILES
Cc1ccc(C(N)(C(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)cc1
InChIKey
YEVKMNLLJOBDCM-AIBWNMTMSA-N
Molecular formula
C22H26N2O2
Average molar mass
350.5 g/mol

Names & identifiers

Preferred name
4-methyl-phenyl-amino-phenyl-acetic acid (R)-(1-aza-bicyclo[2.2.2]oct-3-yl)ester
IUPAC
[(3R)-1-azabicyclo[2.2.2]octan-3-yl] 2-amino-2-(4-methylphenyl)-2-phenylacetate

Names & synonyms

YEVKMNLLJOBDCM-AIBWNMTMSA-N4-methyl-phenyl-amino-phenyl-acetic acid (R)-(1-aza-bicyclo[2.2.2]oct-3-yl)ester

Database identifiers

PubChem CID
86643235

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
55.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
26

Related reactions

4 records
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Compound notes

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