1H-Pyrrolo(2,3-c)pyridine-3-carbaldehyde

C8H6N2OCAS 25957-65-7146.15 g/mol

Open in Covalent MOL file
NNHO
Aldehyde

Properties

Molecular formula
C8H6N2O
Molar mass
146.15 g/mol
Exact mass
146.0480 Da
logP
1.38Crippen estimate
Polar surface area
45.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
25957-65-7
SMILES
C1=CN=CC2=C1C(=CN2)C=O
InChIKey
IAMJYHYPXUQXGI-UHFFFAOYSA-N
InChI
InChI=1S/C8H6N2O/c11-5-6-3-10-8-4-9-2-1-7(6)8/h1-5,10H

Weigh it out

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

Names and synonyms

1 names
  • 6-Azaindole-3-carboxaldehyde

Work with 1H-Pyrrolo(2,3-c)pyridine-3-carbaldehyde

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

Indole-3-carbaldehyde487-89-858 % similar 3-Bromo-1H-pyrrolo[2,3-C]pyridine67058-76-851 % similar 6-Bromoindole-3-carbaldehyde17826-04-950 % similar 6-Fluoroindole-3-carboxaldehyde2795-41-750 % similar 6-Methylindole-3-carboxaldehyde4771-49-750 % similar 6-Chloroindole-3-carboxaldehyde703-82-250 % similar Isoquinoline-5-carboxaldehyde80278-67-749 % similar 1H-Pyrrolo(2,3-c)pyridine-3-carboxylic acid67058-74-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Imidazo[1,2-A]pyridine-6-carbaldehyde116355-16-9 Imidazo(1,2-a)pyridine-2-carbaldehyde118000-43-4 1(2H)-Phthalazinone119-39-1 2(1H)-Quinoxalinone1196-57-2 2-Cyanobenzamide17174-98-0 1H-Indazole-5-carboxaldehyde253801-04-6 1H-Pyrrolo[3,2-B]pyridine-3-carboxaldehyde (9ci)276862-85-2 4-Cyanobenzamide3034-34-2

Elsewhere

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