chempirical

(R)-tert-Butyl 1-methyl-2-oxoimidazolidine-4-carboxylate

C9H16N2O3CAS 143996-78-5200.24 g/mol

Open in Covalent MOL file
OONOHN
EsterUrea

Properties

Molecular formula
C9H16N2O3
Molar mass
200.24 g/mol
Exact mass
200.1161 Da
logP
0.35Crippen estimate
Polar surface area
58.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
143996-78-5
SMILES
CC(C)(C)OC(=O)[C@H]1CN(C(=O)N1)C
InChIKey
JHSLVEQWBDYFQN-ZCFIWIBFSA-N
InChI
InChI=1S/C9H16N2O3/c1-9(2,3)14-7(12)6-5-11(4)8(13)10-6/h6H,5H2,1-4H3,(H,10,13)/t6-/m1/s1

Weigh it out

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

Work with (R)-tert-Butyl 1-methyl-2-oxoimidazolidine-4-carboxylate

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

L-Proline 1,1-dimethylethyl ester2812-46-646 % similar 3-(N-Boc-methylaminomethyl)azetidine1053655-53-043 % similar (S)-Proline tert-butyl ester hydrochloride5497-76-743 % similar (R)-tert-Butyl (2-oxooxetan-3-yl)carbamate126330-77-643 % similar N-Boc-(methylamino)acetaldehyde123387-72-440 % similar tert-Butyl 3-methylpiperazine-1-carboxylate120737-59-938 % similar 1,1-Dimethylethyl 2-bromopropanoate39149-80-938 % similar 1-tert-Butyl 3-methyl piperazine-1,3-dicarboxylate129799-08-237 % similar

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

Same formula

(αS)-Tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetic acid192725-50-1

Elsewhere

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