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2-Amino-2-[6-(4-pentylcyclohexyl)oxynaphthalen-2-yl]propan-1-ol (HCID 67413158)|Huagongshe
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Compound
2-Amino-2-[6-(4-pentylcyclohexyl)oxynaphthalen-2-yl]propan-1-ol
HCID
67413158
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCC1CCC(Oc2ccc3cc(C(C)(N)CO)ccc3c2)CC1
InChIKey
FWSMFGSIAHCWJB-UHFFFAOYSA-N
Molecular formula
C24H35NO2
Average molar mass
369.5 g/mol
Monoisotopic mass
369.26677936
Names & identifiers
Preferred name
2-Amino-2-[6-(4-pentylcyclohexyl)oxynaphthalen-2-yl]propan-1-ol
IUPAC
2-amino-2-[6-(4-pentylcyclohexyl)oxynaphthalen-2-yl]propan-1-ol
Names & synonyms
SCHEMBL2450023
Database identifiers
PubChem CID
67413158
Properties
Computed structural properties
XLogP
5.8
Topological polar surface area
55.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
27
Formal charge
0
Complexity
434
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
961935
As product
Validation data from https://doi.org/10.1039/C8SC04228D
HRID
2328575
As product
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
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