Propacetamol

C14H20N2O3CAS 66532-85-2264.32 g/mol

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NOONHO
EsterTertiary amine

Properties

Molecular formula
C14H20N2O3
Molar mass
264.32 g/mol
Exact mass
264.1474 Da
Melting point
55–57 °C
logP
2.54Crippen estimate
Polar surface area
62.1 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
66532-85-2
SMILES
CCN(CC)CC(=O)Oc1ccc(N=C(C)O)cc1
InChIKey
QTGAJCQTLIRCFL-UHFFFAOYSA-N
InChI
InChI=1S/C14H20N2O3/c1-4-16(5-2)10-14(18)19-13-8-6-12(7-9-13)15-11(3)17/h6-9H,4-5,10H2,1-3H3,(H,15,17)

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Names and synonyms

4 names
  • Glycine, N,N-diethyl-, 4-(acetylamino)phenyl ester
  • 4-Acetamidophenyl (diethylamino)acetate
  • Proparacetamol
  • Denogan

Work with Propacetamol

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Propacetamol hydrochloride66532-86-3Salt

Similar compounds

P-Acetoxyacetanilide2623-33-856 % similar Phenacetin62-44-250 % similar N-(4-Methoxyphenyl)acetamide51-66-147 % similar N,N'-Diacetyl-p-phenylenediamine140-50-145 % similar Benorylate5003-48-544 % similar Actarit18699-02-043 % similar N-[4-(Difluoromethoxy)phenyl]acetamide22236-11-943 % similar N-(4-Acetylphenyl)acetamide2719-21-342 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Vorinostat149647-78-9

Elsewhere

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