4-(4-Oxocyclohexyl)benzamide

C13H15NO2CAS 73204-06-5217.27 g/mol

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H2NOO
AmideKetone

Properties

Molecular formula
C13H15NO2
Molar mass
217.27 g/mol
Exact mass
217.1103 Da
logP
2.01Crippen estimate
Polar surface area
60.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
73204-06-5
SMILES
NC(=O)c1ccc(C2CCC(=O)CC2)cc1
InChIKey
QWCRAYDIXLUPOT-UHFFFAOYSA-N
InChI
InChI=1S/C13H15NO2/c14-13(16)11-3-1-9(2-4-11)10-5-7-12(15)8-6-10/h1-4,10H,5-8H2,(H2,14,16)

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Names and synonyms

1 names
  • Benzamide, 4-(4-oxocyclohexyl)-

Work with 4-(4-Oxocyclohexyl)benzamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Phenylcyclohexanone4894-75-159 % similar 4-(4′-Hydroxyphenyl)cyclohexanone105640-07-159 % similar 4-(4-Methylphenyl)cyclohexanone40503-90-059 % similar Terephthalamide3010-82-050 % similar 4-Aminobenzamide2835-68-942 % similar trans-4′-(3,4-Difluorophenyl)[1,1′-bicyclohexyl]-4-one147622-85-342 % similar 4-Ethylbenzamide33695-58-842 % similar 4-Methylbenzamide619-55-641 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl 4-(4-cyanophenyl)butanoate131379-33-4 N-Benzoyl-4-perhydroazepinone15923-40-7 7-Ethylamino-4,6-dimethylcoumarin26078-25-1 (-)-Securinine5610-40-2 8-Hydroxyjulolidine-9-carboxaldehyde63149-33-7 Benzyl 5,6-dihydropyridine-1(2H)-carboxylate66207-23-6 Ethyl α-cyano-α-ethylbenzeneacetate718-71-8 1-Boc-indole75400-67-8

Elsewhere

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