chempirical

4-(Diethylamino)butan-2-one

C8H17NOCAS 3299-38-5143.23 g/mol

Open in Covalent MOL file
NO
KetoneTertiary amine

Properties

Molecular formula
C8H17NO
Molar mass
143.23 g/mol
Exact mass
143.1310 Da
logP
1.31Crippen estimate
Polar surface area
20.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
5

Identifiers

CAS number
3299-38-5
SMILES
CCN(CC)CCC(=O)C
InChIKey
XLEOCTUCGZANAC-UHFFFAOYSA-N
InChI
InChI=1S/C8H17NO/c1-4-9(5-2)7-6-8(3)10/h4-7H2,1-3H3

Weigh it out

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

Names and synonyms

10 names
  • 2-Butanone, 4-diethylamino-
  • 4-(Diethylamino)-2-butanone
  • 1-(Diethylamino)-3-butanone
  • 4-(N,N-Diethylamino)butan-2-one
  • 1-Diethylamino-3-butanone
  • 2-Butanone, 4-(diethylamino)-
  • 4-Diethylaminobutan-2-one
  • 4-Diethylamino-2-butanone
  • 4-Diethylamino-butan-2-one
  • Ethane, 1-acetyl-2-diethylamino-

Work with 4-(Diethylamino)butan-2-one

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

5-(Diethylamino)-2-pentanone105-14-676 % similar 5-[Ethyl(2-hydroxyethyl)amino]-2-pentanone74509-79-856 % similar 1-Ethyl-4-piperidinone3612-18-854 % similar Hexane-2,5-dione110-13-450 % similar 2-Pentanone107-87-948 % similar N,N,N′,N′-Tetraethylethylenediamine150-77-645 % similar 2-Hexanone591-78-644 % similar Diethylacetoacetamide2235-46-343 % similar

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

Same formula

1-Piperidinepropanol104-58-5 Valpromide2430-27-5 2-(Cyclohexylamino)ethanol2842-38-8 N,N-Dimethylhexanamide5830-30-8 4-Piperidinepropanol7037-49-2

Elsewhere

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