5-(Diethylamino)-2-pentanone

C₉H₁₉NOCAS 105-14-6157.26 g/mol

Open in Covalent MOL file

Ketone Tertiary 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 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 6

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

5-[Ethyl(2-hydroxyethyl)amino]-2-pentanone74509-79-873 % 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 2-Pentadecanone2345-28-048 % similar 2-Tridecanone593-08-848 % similar

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

Same formula

4-Hydroxy-2,2,6,6-tetramethylpiperidine2403-88-5 N,N-Dibutylformamide761-65-9

Elsewhere

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