1H-Pyrrolo(2,3-c)pyridine-3-carboxylic acid

C₈H₆N₂O₂CAS 67058-74-6162.15 g/mol

Open in Covalent MOL file

Carboxylic acid

Properties

Molecular formula: C₈H₆N₂O₂
Molar mass: 162.15 g/mol
Exact mass: 162.0429 Da
logP: 1.26Crippen estimate
Polar surface area: 66.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

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

67058-74-6

SMILES

C1=CN=CC2=C1C(=CN2)C(=O)O

InChIKey

UZICFJZCPFIGIJ-UHFFFAOYSA-N

InChI

InChI=1S/C8H6N2O2/c11-8(12)6-3-10-7-4-9-2-1-5(6)7/h1-4,10H,(H,11,12)

Weigh it out

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

Names and synonyms

1 names

6-Azaindole-3-carboxylic acid

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

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-carboxylic acid771-50-661 % similar Cinchomeronic acid490-11-954 % similar Isoquinoline-5-carboxylic acid27810-64-653 % similar 5-Bromo-1H-indole-3-carboxylic acid10406-06-151 % similar 1H-Pyrrolo(3,2-b)pyridine-3-carboxylic acid860496-20-451 % similar 3-Hydroxy-4-pyridinecarboxylic acid10128-71-950 % similar 5-Chloroindole-3-carboxylic acid10406-05-050 % similar 5-Fluoro-1H-indole-3-carboxylic acid23077-43-250 % similar

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

Same formula

Pyrazolo[1,5-A]pyridine-5-carboxylic acid104468-87-3 3-(5-Azaindole)carboxylic acid119248-43-0 N-Phenylsydnone120-06-9 Imidazo[1,2-A]pyridine-8-carboxylic acid133427-08-4 1H-Pyrrolo[2,3-B]pyridine-2-carboxylic acid136818-50-3 Imidazo(1,2-a)pyridine-6-carboxylic acid139022-25-6 2,3-Dihydro-1,4-phthalazinedione1445-69-8 1H-Pyrrolo(2,3-b)pyridine-3-carboxylic acid156270-06-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook