chempirical

Piperidinium chloride

C5H12ClNCAS 6091-44-7121.61 g/mol

Open in Covalent MOL file
NHHCl
Secondary amine

Properties

Molecular formula
C5H12ClN
Molar mass
121.61 g/mol
Exact mass
121.0658 Da
Melting point
245–248 °C
logP
1.18Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
6091-44-7
SMILES
C1CCNCC1.Cl
InChIKey
VEIWYFRREFUNRC-UHFFFAOYSA-N
InChI
InChI=1S/C5H11N.ClH/c1-2-4-6-5-3-1;/h6H,1-5H2;1H

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

Names and synonyms

2 names
  • Piperidine, hydrochloride
  • Piperidine, hydrochloride (1:1)

Work with Piperidinium chloride

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

Piperidine110-89-475 % similar Azepane111-49-975 % similar Azocane1121-92-275 % similar Pyrrolidine123-75-167 % similar 1,4,7,10-Tetraazacyclododecane, hydrochloride (1:4)10045-25-762 % similar Piperazine hydrochloride142-64-362 % similar Spermine tetrahydrochloride306-67-261 % similar Spermidine trihydrochloride334-50-958 % similar

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

Same formula

3-Chloro-N,N-dimethyl-1-propanamine109-54-6 (2R)-(-)-2-Methylpyrrolidine hydrochloride135324-85-5 1-Amino-1-methylcyclobutane hydrochloride174886-05-6 Cyclobutylmethylamine hydrochloride5454-82-0

Elsewhere

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