1-(4-Iodophenyl)piperidin-2-one

C₁₁H₁₂INOCAS 385425-15-0301.13 g/mol

Open in Covalent MOL file

Amide Aryl halide Lactam

Properties

Molecular formula: C₁₁H₁₂INO
Molar mass: 301.13 g/mol
Exact mass: 300.9964 Da
logP: 2.81Crippen estimate
Polar surface area: 20.3 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

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

Identifiers

CAS number

385425-15-0

SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)I

InChIKey

OYDSTJMVOOOYDW-UHFFFAOYSA-N

InChI

InChI=1S/C11H12INO/c12-9-4-6-10(7-5-9)13-8-2-1-3-11(13)14/h4-7H,1-3,8H2

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Names and synonyms

1 names

1-(4-Iodo-phenyl)-piperidin-2-one

Work with 1-(4-Iodophenyl)piperidin-2-one

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

1-Phenyl-2-pyrrolidinone4641-57-059 % similar 1-(4-Bromophenyl)pyrrolidin-2-one7661-32-758 % similar 1-(4-Nitrophenyl)piperidin-2-one38560-30-457 % similar 4-(2-Oxo-1-pyrrolidinyl)benzaldehyde36151-45-855 % similar 3-Morpholino-1-(4-(2-oxopiperidin-1-yl)phenyl)-5,6-dihydropyridin-2(1H)-one545445-44-147 % similar 1-(4-Iodophenyl)-3-morpholino-5,6-dihydropyridin-2(1H)-one473927-69-439 % similar Tris(4-iodophenyl)amine4181-20-838 % similar 4-(4-Aminophenyl)morpholin-3-one438056-69-036 % similar

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

Elsewhere

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