Name: Name:1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 3-methyl-, methyl ester
Brand: Angene
SKU: AG000OET
Rating: 90 (10 reviews)

1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 3-methyl-, methyl ester

CAS No.:

1256809-63-8

Catalog Number:

AG000OET

Molecular Formula:

C10H10N2O2

Molecular Weight:

190.1986

Catalog Number:

AG000OET

Chemical Name:

1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 3-methyl-, methyl ester

CAS Number:

1256809-63-8

Molecular Formula:

C10H10N2O2

Molecular Weight:

190.1986

IUPAC Name:

methyl 3-methyl-1H-pyrrolo[2,3-b]pyridine-5-carboxylate

InChI:

InChI=1S/C10H10N2O2/c1-6-4-11-9-8(6)3-7(5-12-9)10(13)14-2/h3-5H,1-2H3,(H,11,12)

InChI Key:

IYTGHSWVWZKGAM-UHFFFAOYSA-N

SMILES:

COC(=O)c1cnc2c(c1)c(C)c[nH]2

Complexity:

232

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.202g/mol

Monoisotopic Mass:

190.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5