1-Boc-6-aminoindole

C₁₃H₁₆N₂O₂CAS 219508-62-0232.28 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₆N₂O₂
Molar mass: 232.28 g/mol
Exact mass: 232.1212 Da
logP: 3.01Crippen estimate
Polar surface area: 57.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Identifiers

CAS number

219508-62-0

SMILES

CC(C)(C)OC(=O)N1C=CC2=C1C=C(C=C2)N

InChIKey

KYZMFSVVFOVRNK-UHFFFAOYSA-N

InChI

InChI=1S/C13H16N2O2/c1-13(2,3)17-12(16)15-7-6-9-4-5-10(14)8-11(9)15/h4-8H,14H2,1-3H3

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

Names and synonyms

1 names

tert-Butyl 6-amino-1H-indole-1-carboxylate

Work with 1-Boc-6-aminoindole

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

1-Boc-6-amino-indazole219503-81-862 % similar 1,1-Dimethylethyl 5-amino-1H-indazole-1-carboxylate129488-10-455 % similar tert-Butyl 4-aminobenzoate18144-47-342 % similar N-Boc-2-pyrroleboronic acid135884-31-042 % similar tert-Butyl (4-aminophenyl)carbamate71026-66-940 % similar 1-(tert-Butoxycarbonyl)indole-2-boronic Acid (contains varying amounts of Anhydride)213318-44-638 % similar 1-Boc-6-chloroindole-2-boronic acid352359-22-938 % similar 6-Amino-2-N-boc-1,2,3,4-tetrahydro-isoquinoline164148-92-938 % similar

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

Same formula

Aminoglutethimide125-84-8 1,1-Dimethylethyl 5-amino-1H-indole-1-carboxylate166104-20-7 3-[[2-(Acetyloxy)ethyl]phenylamino]propanenitrile22031-33-0 Melatonin73-31-4

Elsewhere

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