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Compound
2-[Dimethylamino(phenyl)methyl]-1-[(4-methoxyphenyl)methyl]cyclohexan-1-ol
HCID
9798651
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Basic information
Standard SMILES
COc1ccc(CC2(O)CCCCC2C(c2ccccc2)N(C)C)cc1
InChIKey
WBCYOSSZAJLKEG-UHFFFAOYSA-N
Molecular formula
C23H31NO2
Average molar mass
353.5 g/mol
Names & identifiers
Preferred name
2-[Dimethylamino(phenyl)methyl]-1-[(4-methoxyphenyl)methyl]cyclohexan-1-ol
IUPAC
2-[dimethylamino(phenyl)methyl]-1-[(4-methoxyphenyl)methyl]cyclohexan-1-ol
Names & synonyms
SCHEMBL6939728
Database identifiers
PubChem CID
9798651
Properties
Computed structural properties
XLogP
4.6
Topological polar surface area
32.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
26
Formal charge
0
Complexity
412
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Related reactions
1 records
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HRID
173010
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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