6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine

C13H11N3O — CID 77106234

IUPAC6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine
SMILESCOc1ccc2c(-c3ccncc3)c[nH]c2n1
InChIInChI=1S/C13H11N3O/c1-17-12-3-2-10-11(8-15-13(10)16-12)9-4-6-14-7-5-9/h2-8H,1H3,(H,15,16)
InChIKeyTZFBRBFUNGMUNQ-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.63
Rot. Bonds2

About 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine

6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 77106234) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine
PubChem CID77106234
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine
SMILESCOc1ccc2c(-c3ccncc3)c[nH]c2n1
InChIInChI=1S/C13H11N3O/c1-17-12-3-2-10-11(8-15-13(10)16-12)9-4-6-14-7-5-9/h2-8H,1H3,(H,15,16)
InChIKeyTZFBRBFUNGMUNQ-UHFFFAOYSA-N
XLogP2.63
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine (CID 77106234) is 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine is COc1ccc2c(-c3ccncc3)c[nH]c2n1.
What is the InChIKey of 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is TZFBRBFUNGMUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-17-12-3-2-10-11(8-15-13(10)16-12)9-4-6-14-7-5-9/h2-8H,1H3,(H,15,16).
What are the key properties of 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine?
6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 225.25 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 77106234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).