chempirical

Ciclopirox

C12H17NO2CAS 29342-05-0207.27 g/mol

Open in Covalent MOL file
NOHO

Properties

Molecular formula
C12H17NO2
Molar mass
207.27 g/mol
Exact mass
207.1259 Da
Melting point
144 °C
logP
2.44Crippen estimate
Polar surface area
42.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
29342-05-0
SMILES
Cc1cc(C2CCCCC2)n(O)c(=O)c1
InChIKey
SCKYRAXSEDYPSA-UHFFFAOYSA-N
InChI
InChI=1S/C12H17NO2/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • 2(1H)-Pyridinone, 6-cyclohexyl-1-hydroxy-4-methyl-
  • 2(1H)-Pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-
  • 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridinone
  • HOE 296b
  • Penlac
  • 1-Hydroxy-4-methyl-6-cyclohexyl-2-pyridinone
  • Ciclopoli

Work with Ciclopirox

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

Ciclopirox olamine41621-49-278 % similar 2,2′-Methylenebis(4-methyl-6-cyclohexylphenol)4066-02-838 % similar Piroctone olamine68890-66-436 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl 2-[4-(dimethylamino)phenyl]acetate17078-29-4 N-Ethyl-N-phenyl-β-alanine methyl ester21608-06-0 4-[Ethyl(2-hydroxyethyl)amino]-2-methylbenzaldehyde21850-52-2 N-(Phenylmethyl)-β-alanine ethyl ester23583-21-3 Hexyl nicotinate23597-82-2 Promecarb2631-37-0 Fenobucarb3766-81-2 4-(Phenylmethyl)-2-morpholinemethanol40987-24-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook