Name: Name:1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile, 2,3-dihydro-2-oxo-
Brand: Angene
SKU: AG000HKU
Rating: 90 (10 reviews)

1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile, 2,3-dihydro-2-oxo-

CAS No.:

1190313-69-9

Catalog Number:

AG000HKU

Molecular Formula:

C8H5N3O

Molecular Weight:

159.1448

Catalog Number:

AG000HKU

Chemical Name:

1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile, 2,3-dihydro-2-oxo-

CAS Number:

1190313-69-9

Molecular Formula:

C8H5N3O

Molecular Weight:

159.1448

MDL Number:

MFCD12962691

IUPAC Name:

2-oxo-1,3-dihydropyrrolo[2,3-b]pyridine-4-carbonitrile

InChI:

InChI=1S/C8H5N3O/c9-4-5-1-2-10-8-6(5)3-7(12)11-8/h1-2H,3H2,(H,10,11,12)

InChI Key:

ZRXDQYMPBJRMIO-UHFFFAOYSA-N

SMILES:

N#Cc1ccnc2c1CC(=O)N2

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

159.043g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

159.148g/mol

Monoisotopic Mass:

159.043g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2