2-Oxo-2,3-dihydro-1H-indole-7-carbonitrile

C₉H₆N₂OCAS 380427-40-7158.16 g/mol

Open in Covalent MOL file

Amide Lactam Nitrile

Properties

Molecular formula: C₉H₆N₂O
Molar mass: 158.16 g/mol
Exact mass: 158.0480 Da
logP: 1.05Crippen estimate
Polar surface area: 52.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

380427-40-7

SMILES

C1C2=C(C(=CC=C2)C#N)NC1=O

InChIKey

SYZZMPZKZBRDNH-UHFFFAOYSA-N

InChI

InChI=1S/C9H6N2O/c10-5-7-3-1-2-6-4-8(12)11-9(6)7/h1-3H,4H2,(H,11,12)

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Names and synonyms

1 names

7-Cyanooxindole

Work with 2-Oxo-2,3-dihydro-1H-indole-7-carbonitrile

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

7-Nitrooxindole25369-31-749 % similar 7-Indolinecarbonitrile115661-82-049 % similar 2-Cyanobenzeneacetic acid18698-99-248 % similar 1-Naphthaleneacethydrazide34800-90-342 % similar 2,3-Dihydro-1-oxo-1H-indene-4-carbonitrile60899-34-542 % similar 2-Cyanobenzoic acid3839-22-340 % similar 1,2,3,4-Tetrahydroquinolin-2-one553-03-740 % similar 2-Cyanobenzyl bromide22115-41-939 % similar

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

Same formula

Quinoxaline-6-carbaldehyde130345-50-5 Quinoxaline-2-carbaldehyde1593-08-4

Elsewhere

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