5-Nitro-1H-pyrrolo[2,3-B]pyridine

C₇H₅N₃O₂CAS 101083-92-5163.14 g/mol

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Properties

Molecular formula: C₇H₅N₃O₂
Molar mass: 163.14 g/mol
Exact mass: 163.0382 Da
logP: 1.47Crippen estimate
Polar surface area: 71.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

101083-92-5

SMILES

C1=CNC2=NC=C(C=C21)[N+](=O)[O-]

InChIKey

INMIPMLIYKQQID-UHFFFAOYSA-N

InChI

InChI=1S/C7H5N3O2/c11-10(12)6-3-5-1-2-8-7(5)9-4-6/h1-4H,(H,8,9)

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

Names and synonyms

1 names

5-Nitro-7-azaindole

Work with 5-Nitro-1H-pyrrolo[2,3-B]pyridine

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

5-Nitroindole6146-52-757 % similar 6-Nitroindole4769-96-453 % similar 2-Fluoro-5-nitropyridine456-24-647 % similar 1H-Pyrrolo[2,3-B]pyridin-5-ylamine100960-07-446 % similar 2,3-Dibromo-5-nitropyridine15862-36-945 % similar 2,3-Dichloro-5-nitropyridine22353-40-845 % similar 2-Chloro-3,5-dinitropyridine2578-45-245 % similar 3,5-Dinitro-2(1H)-pyridinone2980-33-845 % similar

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

Same formula

1H-Pyrazolo[3,4-B]pyridine-3-carboxylicacid(9ci)116855-08-4 2-Cyano-4-nitroaniline17420-30-3 3,4-Dihydro-3-hydroxy-4-oxo-1,2,3-benzotriazine28230-32-2 4-Nitro-1H-indazole2942-40-7 7-Nitroindazole2942-42-9 5-Nitroindazole5401-94-5 4-Amino-3-nitrobenzonitrile6393-40-4 4-Azidobenzoic acid6427-66-3

Elsewhere

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