4-Aminotetrahydro-2H-pyran-4-carboxylic acid

C₆H₁₁NO₃CAS 39124-20-4145.16 g/mol

Open in Covalent MOL file

Carboxylic acid Ether Primary amine

Properties

Molecular formula: C₆H₁₁NO₃
Molar mass: 145.16 g/mol
Exact mass: 145.0739 Da
logP: -0.42Crippen estimate
Polar surface area: 72.5 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Identifiers

CAS number

39124-20-4

SMILES

C1COCCC1(C(=O)O)N

InChIKey

DPDPQQHHTHKSRN-UHFFFAOYSA-N

InChI

InChI=1S/C6H11NO3/c7-6(5(8)9)1-3-10-4-2-6/h1-4,7H2,(H,8,9)

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Names and synonyms

1 names

4-Amino-tetrahydro-pyran-4-carboxylic acid

Work with 4-Aminotetrahydro-2H-pyran-4-carboxylic 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

Similar compounds

3-Aminotetrahydrofuran-3-carboxylic acid125218-55-578 % similar 1-Aminocyclopropane-1-carboxylic acid22059-21-871 % similar 1-Amino-cyclobutanecarboxylic acid22264-16-065 % similar 1-Aminocyclobutanecarboxylic acid22264-50-265 % similar Cycloleucine52-52-865 % similar 1-Amino-1-cyclopropanecarboxylic acid hydrochloride68781-13-565 % similar 3-Aminooxetane-3-carboxylic acid138650-24-563 % similar 1-Aminocyclohexanecarboxylic acid2756-85-663 % similar

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

Same formula

Ethyl N,N-dimethyloxamate16703-52-9 Ethyl acetamidoacetate1906-82-7 N,N-Dimethylsuccinamic acid2564-95-6 4-Acetamidobutyric acid3025-96-5 4-Morpholineacetic acid3235-69-6 Ac-ala-ome3619-02-1 N-Formyl-L-valine4289-97-8 2-(Acetylamino)butanoic acid7211-57-6

Elsewhere

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