6-Methyl-1H-pyrrolo[2,3-b]pyridine

C8H8N2CAS 824-51-1132.17 g/mol

Open in Covalent MOL file
NHN

Properties

Molecular formula
C8H8N2
Molar mass
132.17 g/mol
Exact mass
132.0687 Da
Melting point
140.3–140.4 °C
logP
1.87Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
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
824-51-1
SMILES
Cc1ccc2cc[nH]c2n1
InChIKey
YQDMUZFABFBKJN-UHFFFAOYSA-N
InChI
InChI=1S/C8H8N2/c1-6-2-3-7-4-5-9-8(7)10-6/h2-5H,1H3,(H,9,10)

Weigh it out

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

Names and synonyms

1 names
  • 1H-Pyrrolo[2,3-b]pyridine, 6-methyl-

Work with 6-Methyl-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

6-Bromo-1H-pyrrolo[2,3-B]pyridine143468-13-753 % similar 6-Chloro-1H-pyrrolo[2,3-B]pyridine55052-27-253 % similar 6-Fluoro-1H-pyrrolo(2,3-b)pyridine898746-42-453 % similar 6-Methoxy-1H-pyrrolo[2,3-b]pyridine896722-53-553 % similar 1H-Pyrrolo[2,3-b]pyridine-6-carbonitrile189882-33-548 % similar Neocuproine484-11-748 % similar Methyl 7-azaindole-6-carboxylate1256825-86-146 % similar 2-Amino-4-methylpyrimidine108-52-145 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Cyanobenzylamine10406-25-4 1-Methylbenzimidazole1632-83-3 5-Methyl-1H-indazole1776-37-0 2-Methyl-7-azaindole23612-48-8 2-Amino-4-methylbenzonitrile26830-96-6 Phenylglycine nitrile2973-50-4 2-(Phenylamino)acetonitrile3009-97-0 3-Methyl-1H-indazole3176-62-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook