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2-(4-Dimethylamino-4-phenyl-cyclohexyl)-N-p-tolyl-acetamide

HCID 11610744
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1ccc(NC(=O)CC2CCC(c3ccccc3)(N(C)C)CC2)cc1
InChIKey
XIGQHSXQTFJKEY-UHFFFAOYSA-N
Molecular formula
C23H30N2O
Average molar mass
350.5 g/mol
Monoisotopic mass
350.23581359

Names & identifiers

Preferred name
2-(4-Dimethylamino-4-phenyl-cyclohexyl)-N-p-tolyl-acetamide
IUPAC
2-[4-(dimethylamino)-4-phenylcyclohexyl]-N-(4-methylphenyl)acetamide

Names & synonyms

SCHEMBL2378584XIGQHSXQTFJKEY-UHFFFAOYSA-N2-(4-Dimethylamino-4-phenyl-cyclohexyl)-N-p-tolyl-acetamide

Database identifiers

PubChem CID
11610744

Properties

Computed structural propertiesFilling in

XLogP
4.2
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
26
Formal charge
0
Complexity
439

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Related reactions

4 records
New reaction record
HRID 664432 reaction equation
HRID 664432As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 908999 reaction equation
HRID 908999As productuspto-grants-2011_09
HRID 909000 reaction equation
HRID 909000As reactantuspto-grants-2011_09
HRID 1127323 reaction equation
HRID 1127323As productAs reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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