1-Boc-3-(amino)azetidine

C₈H₁₆N₂O₂CAS 193269-78-2172.23 g/mol

Open in Covalent MOL file

Carbamate Primary amine

Properties

Molecular formula: C₈H₁₆N₂O₂
Molar mass: 172.23 g/mol
Exact mass: 172.1212 Da
logP: 0.56Crippen estimate
Polar surface area: 55.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Identifiers

CAS number

193269-78-2

SMILES

CC(C)(C)OC(=O)N1CC(C1)N

InChIKey

WPGLRFGDZJSQGI-UHFFFAOYSA-N

InChI

InChI=1S/C8H16N2O2/c1-8(2,3)12-7(11)10-4-6(9)5-10/h6H,4-5,9H2,1-3H3

Weigh it out

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

Names and synonyms

1 names

tert-Butyl 3-aminoazetidine-1-carboxylate

Work with 1-Boc-3-(amino)azetidine

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

(S)-(-)-1-tert-Butoxycarbonyl-3-aminopyrrolidine147081-44-576 % similar (R)-tert-Butyl 3-aminopyrrolidine-1-carboxylate147081-49-076 % similar tert-Butyl 3-aminopyrrolidine-1-carboxylate186550-13-076 % similar 1-Boc-3-aminopiperidine144243-24-371 % similar N-Boc-3-aminopiperidine184637-48-771 % similar (R)-1-Boc-3-aminopiperidine188111-79-771 % similar (S)-tert-Butyl 3-aminopiperidine-1-carboxylate625471-18-371 % similar tert-Butyl 4-aminopiperidine-1-carboxylate87120-72-770 % similar

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

Same formula

1-(Ethoxycarbonylmethyl)piperazine40004-08-8 Ethyl 4-amino-1-piperidinecarboxylate58859-46-4

Elsewhere

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