2-Chloro-1-(1-piperidinyl)ethanone

C₇H₁₂ClNOCAS 1440-60-4161.63 g/mol

Open in Covalent MOL file

Alkyl halide Amide

Properties

Molecular formula: C₇H₁₂ClNO
Molar mass: 161.63 g/mol
Exact mass: 161.0607 Da
Density: 1.1703 g/mL (at 20 °C)
Boiling point: 143.5–145.5 °C (at 12.5 Torr)
logP: 1.24Crippen estimate
Polar surface area: 20.3 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

1440-60-4

SMILES

O=C(CCl)N1CCCCC1

InChIKey

NSWLMOHUXYULKL-UHFFFAOYSA-N

InChI

InChI=1S/C7H12ClNO/c8-6-7(10)9-4-2-1-3-5-9/h1-6H2

Weigh it out

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

Names and synonyms

10 names

Ethanone, 2-chloro-1-(1-piperidinyl)-
Piperidine, 1-(chloroacetyl)-
1-(Chloroacetyl)piperidine
α-Chloroacetopiperidide
N-(Chloroacetyl)piperidine
Chloroacetic acid piperidine amide
NSC 8198
1-(2-Chloroacetyl)piperidine
2-Chloro-1-(piperidin-1-yl)ethanone
2-Chloro-1-(piperidin-1-yl)ethan-1-one

Work with 2-Chloro-1-(1-piperidinyl)ethanone

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

2-Chloro-1-(1-pyrrolidinyl)ethanone20266-00-695 % similar 4-(Chloroacetyl)morpholine1440-61-560 % similar Chloro-N,N-diethylacetamide2315-36-852 % similar β-Oxo-1-piperidinepropanenitrile15029-30-850 % similar N-Octylpyrrolidone2687-94-748 % similar N-Dodecyl-2-pyrrolidone2687-96-948 % similar Laurocapram59227-89-348 % similar β-Oxo-1-pyrrolidinepropanenitrile14227-95-346 % similar

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

Same formula

3-Quinuclidone hydrochloride1193-65-3

Elsewhere

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