chempirical

Cyclobutanecarboxamide

C5H9NOCAS 1503-98-699.13 g/mol

Open in Covalent MOL file
ONH2
Amide

Properties

Molecular formula
C5H9NO
Molar mass
99.13 g/mol
Exact mass
99.0684 Da
logP
0.27Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
1503-98-6
SMILES
C1CC(C1)C(=O)N
InChIKey
MFNYBOWJWGPXFM-UHFFFAOYSA-N
InChI
InChI=1S/C5H9NO/c6-5(7)4-2-1-3-4/h4H,1-3H2,(H2,6,7)

Weigh it out

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

Work with Cyclobutanecarboxamide

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

Cyclobutanecarboxylic acid3721-95-742 % similar Cyclobutanecarbonyl chloride5006-22-442 % similar 2-Methylmalonamide1113-63-939 % similar Cyclohexyl ketone119-60-839 % similar 1,3-Cyclohexanedicarboxylic acid3971-31-138 % similar tert-Butyl 3-carbamoylpyrrolidine-1-carboxylate122684-34-838 % similar 2,6-Dimethylcyclohexanone2816-57-136 % similar Cyclopentanecarboxylic acid3400-45-136 % similar

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

Same formula

2-Ethyl-2-oxazoline10431-98-8 Butyl isocyanate111-36-4 4-Amino-3-penten-2-one1118-66-7 Cyclopentanone oxime1192-28-5 tert-Butyl isocyanate1609-86-5 2-Oxa-6-azaspiro[3.3]heptane174-78-7 3-Ethoxypropanenitrile2141-62-0 N,N-Dimethylacrylamide2680-03-7

Elsewhere

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