chempirical

1-Amino-cyclobutanecarboxylic acid

C5H9NO2CAS 22264-16-0115.13 g/mol

Open in Covalent MOL file
OOHNH2
Carboxylic acidPrimary amine

Properties

Molecular formula
C5H9NO2
Molar mass
115.13 g/mol
Exact mass
115.0633 Da
logP
-0.05Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
22264-16-0
SMILES
C1CC(C1)(C(=O)O)N
InChIKey
FVTVMQPGKVHSEY-UHFFFAOYSA-N
InChI
InChI=1S/C5H9NO2/c6-5(4(7)8)2-1-3-5/h1-3,6H2,(H,7,8)

Weigh it out

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

Names and synonyms

1 names
  • 1-Aminocyclobutanecarboxylic acid

Work with 1-Amino-cyclobutanecarboxylic acid

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.

1-Aminocyclobutanecarboxylic acid hydrochloride98071-16-0Salt 1-Aminocyclobutanecarboxylic acid22264-50-2

Similar compounds

Cycloleucine52-52-890 % similar 1-Aminocyclohexanecarboxylic acid2756-85-686 % similar 1-Aminocyclopropane-1-carboxylic acid22059-21-881 % similar 1-Amino-1-cyclopropanecarboxylic acid hydrochloride68781-13-574 % similar 4-Aminotetrahydro-2H-pyran-4-carboxylic acid39124-20-465 % similar 3-Aminooxetane-3-carboxylic acid138650-24-558 % similar 3-Aminotetrahydrofuran-3-carboxylic acid125218-55-555 % similar 1,1-Cyclobutanedicarboxylic acid5445-51-254 % similar

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

Same formula

N-Methyldiacetamide1113-68-4 1-(3-Hydroxy-1-azetidinyl)ethanone118972-96-6 Methyl 3-amino-2-butenoate14205-39-1 Proline147-85-3 N-(Hydroxymethyl)-2-pyrrolidone15438-71-8 s-Allylglycine16338-48-0 (5S)-5-(Hydroxymethyl)-2-pyrrolidinone17342-08-4 N-Methylacetoacetamide20306-75-6

Elsewhere

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