chempirical

1-(2-Oxoazepane-1-carbonyl)azepan-2-one

C13H20N2O3CAS 19494-73-6252.31 g/mol

Open in Covalent MOL file
ONONO
AmideLactamUrea

Properties

Molecular formula
C13H20N2O3
Molar mass
252.31 g/mol
Exact mass
252.1474 Da
logP
1.91Crippen estimate
Polar surface area
57.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Hazards

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

Identifiers

CAS number
19494-73-6
SMILES
C1CCC(=O)N(CC1)C(=O)N2CCCCCC2=O
InChIKey
UHQZGWJEFFDHSR-UHFFFAOYSA-N
InChI
InChI=1S/C13H20N2O3/c16-11-7-3-1-5-9-14(11)13(18)15-10-6-2-4-8-12(15)17/h1-10H2

Weigh it out

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

Work with 1-(2-Oxoazepane-1-carbonyl)azepan-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

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

Elsewhere

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