chempirical

3-(Piperidin-4-yl)quinolin-2(1H)-one hydrochloride

C14H17ClN2OCAS 855778-84-6264.75 g/mol

Open in Covalent MOL file
HNNHOHCl
Secondary amine

Properties

Molecular formula
C14H17ClN2O
Molar mass
264.75 g/mol
Exact mass
264.1029 Da
logP
2.42Crippen estimate
Polar surface area
44.9 Ų
H-bond donors / acceptors
2 / 2
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
855778-84-6
SMILES
C1CNCCC1C2=CC3=CC=CC=C3NC2=O.Cl
InChIKey
BAPAUBKDZOEWJL-UHFFFAOYSA-N
InChI
InChI=1S/C14H16N2O.ClH/c17-14-12(10-5-7-15-8-6-10)9-11-3-1-2-4-13(11)16-14;/h1-4,9-10,15H,5-8H2,(H,16,17);1H

Weigh it out

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Work with 3-(Piperidin-4-yl)quinolin-2(1H)-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-(4-Piperidinyl)-1H-indole17403-09-743 % similar 4-Phenylpiperidine hydrochloride10272-49-843 % similar 2-(4-Piperidinyl)-1H-benzimidazole38385-95-443 % similar (R)-3-Phenyl-pyrrolidine hydrochloride851000-46-938 % similar 3-Phenyl-pyrrolidine hydrochloride857281-02-838 % similar Quinoxalinedione15804-19-036 % similar 2,3-Dihydroxyquinoxaline6287-20-336 % similar 4-Phenylpiperidine771-99-336 % similar

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

Elsewhere

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