5-(Diethylamino)-2-pentanone

C9H19NOCAS 105-14-6157.26 g/mol

Open in Covalent MOL file
NO
KetoneTertiary amine

Properties

Molecular formula
C9H19NO
Molar mass
157.26 g/mol
Exact mass
157.1467 Da
Boiling point
94–95 °C (at 20 Torr)
logP
1.70Crippen estimate
Polar surface area
20.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
105-14-6
SMILES
CCN(CC)CCCC(C)=O
InChIKey
GRGNJBKJCVOFEO-UHFFFAOYSA-N
InChI
InChI=1S/C9H19NO/c1-4-10(5-2)8-6-7-9(3)11/h4-8H2,1-3H3

Weigh it out

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

Names and synonyms

5 names
  • 2-Pentanone, 5-(diethylamino)-
  • Novol ketone
  • Novalketone
  • NSC 6320
  • N,N-Diethyl-4-oxopentanamine

Work with 5-(Diethylamino)-2-pentanone

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

4-(Diethylamino)butan-2-one3299-38-576 % similar 5-[Ethyl(2-hydroxyethyl)amino]-2-pentanone74509-79-873 % similar 2,15-Hexadecanedione18650-13-052 % similar 2-Hexanone591-78-652 % similar 2-Heptanone110-43-050 % similar 2-Octanone111-13-748 % similar 2-Undecanone112-12-948 % similar 2-Tetradecanone2345-27-948 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(R)-2-Amino-3-cyclohexylpropan-1-ol205445-49-4 4-Hydroxy-2,2,6,6-tetramethylpiperidine2403-88-5 N,N-Dibutylformamide761-65-9 trans-2-(4-Amino-cyclohexyl)-propan-2-ol899806-45-2

Elsewhere

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