Piperidin-3-one hydrochloride

C₅H₁₀ClNOCAS 61644-00-6135.59 g/mol

Open in Covalent MOL file

Ketone Secondary amine

Properties

Molecular formula: C₅H₁₀ClNO
Molar mass: 135.59 g/mol
Exact mass: 135.0451 Da
logP: 0.36Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

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

61644-00-6

SMILES

C1CC(=O)CNC1.Cl

InChIKey

KDHKOJFFKXGPKZ-UHFFFAOYSA-N

InChI

InChI=1S/C5H9NO.ClH/c7-5-2-1-3-6-4-5;/h6H,1-4H2;1H

Weigh it out

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

Work with Piperidin-3-one hydrochloride

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

3-Pyrrolidinone, hydrochloride (1:1)3760-52-974 % similar Azepan-4-one hydrochloride50492-22-368 % similar 3-Pyrrolidinone96-42-461 % similar Azetidin-3-one Hydrochloride17557-84-557 % similar 4-Piperidone hydrochloride hydrate320589-77-346 % similar 4-Piperidinone41661-47-640 % similar 2-Methylpiperidin-4-one hydrochloride13729-77-639 % similar Cyclobutanone1191-95-339 % similar

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

Same formula

2-Chloro-N-(1-methylethyl)acetamide2895-21-8 (1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptane hcl31560-06-2 4-Piperidone hydrochloride41979-39-9 Diethylcarbamoyl chloride88-10-8

Elsewhere

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