5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine

C15H10BrN3 — CID 44553769

IUPAC5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESBrc1ccc2[nH]c(-c3cnc4[nH]ccc4c3)cc2c1
InChIInChI=1S/C15H10BrN3/c16-12-1-2-13-10(6-12)7-14(19-13)11-5-9-3-4-17-15(9)18-8-11/h1-8,19H,(H,17,18)
InChIKeyMAKGPDPVHCTHNN-UHFFFAOYSA-N
MW312.17 g/mol
LogP4.47
Rot. Bonds1

About 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine

5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 44553769) has the molecular formula C15H10BrN3 and a molecular weight of 312.17 g/mol. Its IUPAC name is 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID44553769
Molecular FormulaC15H10BrN3
Molecular Weight312.17 g/mol
Exact Mass311.01
IUPAC Name5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESBrc1ccc2[nH]c(-c3cnc4[nH]ccc4c3)cc2c1
InChIInChI=1S/C15H10BrN3/c16-12-1-2-13-10(6-12)7-14(19-13)11-5-9-3-4-17-15(9)18-8-11/h1-8,19H,(H,17,18)
InChIKeyMAKGPDPVHCTHNN-UHFFFAOYSA-N
XLogP4.47
TPSA44.47 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.17
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 5-(5-bromo-1H-indol-2-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 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine (CID 44553769) is 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine is Brc1ccc2[nH]c(-c3cnc4[nH]ccc4c3)cc2c1.
What is the InChIKey of 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is MAKGPDPVHCTHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrN3/c16-12-1-2-13-10(6-12)7-14(19-13)11-5-9-3-4-17-15(9)18-8-11/h1-8,19H,(H,17,18).
What are the key properties of 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine?
5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 312.17 g/mol, XLogP of 4.47, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-bromo-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 44553769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).