2-Methylpiperidin-4-one hydrochloride

C6H12ClNOCAS 13729-77-6149.62 g/mol

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OHNHCl
KetoneSecondary amine

Properties

Molecular formula
C6H12ClNO
Molar mass
149.62 g/mol
Exact mass
149.0607 Da
logP
0.75Crippen estimate
Polar surface area
29.1 Ų
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.

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Identifiers

CAS number
13729-77-6
SMILES
CC1CC(=O)CCN1.Cl
InChIKey
ACXLFVKOKDSUOU-UHFFFAOYSA-N
InChI
InChI=1S/C6H11NO.ClH/c1-5-4-6(8)2-3-7-5;/h5,7H,2-4H2,1H3;1H

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Names and synonyms

1 names
  • 2-Methyl-4-piperidinone hydrochloride

Work with 2-Methylpiperidin-4-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

Pyrrolidin-3-one hydrochloride3760-52-947 % similar 4-Piperidone hydrochloride41979-39-945 % similar (2R)-(-)-2-Methylpyrrolidine hydrochloride135324-85-542 % similar (S)-2-Methylpyrrolidine hydrochloride174500-74-442 % similar 2-Methylpyrrolidine hydrochloride54677-53-142 % similar 4-Piperidone hydrochloride hydrate320589-77-341 % similar Piperidin-3-one hydrochloride61644-00-639 % similar (3S)-3-Methylmorpholine hydrochloride1022094-03-638 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Cyclopentene-1-methanol, 4-amino-, hydrochloride (1:1), (1S,4R)-168960-19-8 Chloro-N,N-diethylacetamide2315-36-8 4-(2-Chloroethyl)morpholine3240-94-6 3-Methylpiperidin-4-one hydrochloride4629-78-1 Azepan-4-one hydrochloride50492-22-3 4-Aminocyclohexanone hydrochloride675112-40-0 3-Oxa-8-azabicyclo(3.2.1)octane hydrochloride904316-92-3

Elsewhere

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