chempirical

1H-Pyrrolo[2,3-C]pyridine

C7H6N2CAS 271-29-4118.14 g/mol

Open in Covalent MOL file
NHN

Properties

Molecular formula
C7H6N2
Molar mass
118.14 g/mol
Exact mass
118.0531 Da
Melting point
137 °C
logP
1.56Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
271-29-4
SMILES
c1cc2cc[nH]c2cn1
InChIKey
XLKDJOPOOHHZAN-UHFFFAOYSA-N
InChI
InChI=1S/C7H6N2/c1-3-8-5-7-6(1)2-4-9-7/h1-5,9H

Weigh it out

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

Names and synonyms

3 names
  • 6-Azaindole
  • 1,6-Diazaindene
  • Harmyrine

Work with 1H-Pyrrolo[2,3-C]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

1H-Pyrrolo[3,2-C]pyridine271-34-168 % similar 5-Bromo-1H-pyrrolo[2,3-c]pyridine1215387-58-844 % similar 5-Chloro-1H-pyrrolo[2,3-C]pyridine131084-55-444 % similar Isoquinoline119-65-341 % similar 5,6-Dihydroxyindole3131-52-040 % similar 6-Iodo-1H-indole115666-47-239 % similar 6-Chloroindole17422-33-239 % similar 6-Hydroxyindole2380-86-139 % similar

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

Same formula

3-(Cyanomethylene)cyclobutanecarbonitrile1153949-98-4 Pyridin-4-yl-acetonitrile13121-99-8 6-Methyl-2-pyridinecarbonitrile1620-75-3 4-Methyl-2-pyridinecarbonitrile1620-76-4 5-Methyl-2-pyridinecarbonitrile1620-77-5 2-Aminobenzonitrile1885-29-6 3-Methyl-2-pyridinecarbonitrile20970-75-6 3-Aminobenzonitrile2237-30-1

Elsewhere

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