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

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Related Compounds

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CID 401171
Meridianin C
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4-(1H-indol-3-yl)pyrimidin-2-amine
CID 400433
Meridianin F
CID 10044516
Aplicyanin A
CID 16718383
5-bromo-1H-pyrrolo[2,3-b]pyridine
CID 10307932
9H-Pyrido(2,3-b)indole
CID 67486
1H-Purin-6-amine, N-(2-(1H-indol-3-yl)ethyl)-
CID 165348
N-(3-bromophenyl)-9H-pyrimido[4,5-b]indol-4-amine
CID 5328392
4-N-(3-bromophenyl)-9H-pyrimido[4,5-b]indole-2,4-diamine
CID 5328396
11-Bromo-5,6,7,8-Tetrahydropyrimido[4',5':3,4]cyclohepta[1,2-B]indol-2-Amine
CID 58221397

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).