chempirical

1-Acetylpiperidine

C7H13NOCAS 618-42-8127.19 g/mol

Open in Covalent MOL file
ON
Amide

Properties

Molecular formula
C7H13NO
Molar mass
127.19 g/mol
Exact mass
127.0997 Da
Melting point
−13.4 °C
Boiling point
226.5 °C
logP
1.02Crippen estimate
Polar surface area
20.3 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
618-42-8
SMILES
CC(=O)N1CCCCC1
InChIKey
KDISMIMTGUMORD-UHFFFAOYSA-N
InChI
InChI=1S/C7H13NO/c1-7(9)8-5-3-2-4-6-8/h2-6H2,1H3

Weigh it out

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

Names and synonyms

8 names
  • Ethanone, 1-(1-piperidinyl)-
  • Piperidine, 1-acetyl-
  • 1-(1-Piperidinyl)ethanone
  • Acetic acid, piperidide
  • N-Acetylpiperidine
  • Acetylpiperidide
  • NSC 239
  • 1-(Piperidin-1-yl)ethan-1-one

Work with 1-Acetylpiperidine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Acetylpyrrolidine4030-18-694 % similar 1-Acetylpiperazine13889-98-058 % similar N-Acetylmorpholine1696-20-458 % similar 1-Acetyl-4-piperidone32161-06-158 % similar N,N-Diethylacetamide685-91-652 % similar Acetylcaprolactam1888-91-152 % similar Tetraacetylethylenediamine10543-57-450 % similar 1-Acetyl-4-piperidinecarboxylic acid25503-90-647 % similar

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

Same formula

tert-Butylacrylamide107-58-4 Cyclohexanecarboxamide1122-56-1 N-Isopropylmethacrylamide13749-61-6 (±)-3-Quinuclidinol1619-34-7 1-Aza-2-methoxy-1-cycloheptene2525-16-8 Hexyl isocyanate2525-62-4 (R)-3-Quinuclidinol25333-42-0 N-Methylcaprolactam2556-73-2

Elsewhere

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