3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine

C12H8BrN3 — CID 69218432

IUPAC3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine
SMILESBrc1cn(-c2ccccn2)c2cnccc12
InChIInChI=1S/C12H8BrN3/c13-10-8-16(12-3-1-2-5-15-12)11-7-14-6-4-9(10)11/h1-8H
InChIKeyDYTUBYDMORFIQE-UHFFFAOYSA-N
MW274.12 g/mol
LogP3.18
Rot. Bonds1

About 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine

3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine (PubChem CID 69218432) has the molecular formula C12H8BrN3 and a molecular weight of 274.12 g/mol. Its IUPAC name is 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine
PubChem CID69218432
Molecular FormulaC12H8BrN3
Molecular Weight274.12 g/mol
Exact Mass272.99
IUPAC Name3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine
SMILESBrc1cn(-c2ccccn2)c2cnccc12
InChIInChI=1S/C12H8BrN3/c13-10-8-16(12-3-1-2-5-15-12)11-7-14-6-4-9(10)11/h1-8H
InChIKeyDYTUBYDMORFIQE-UHFFFAOYSA-N
XLogP3.18
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.12
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Glu-P 1
CID 49971
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6-Bromo-8-methylimidazo(1,2-a)pyridine
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1-Methyl-2-pyridin-4-YL-1H-benzoimidazole
CID 786430
2-(4-Bromophenyl)-7-methylimidazo[1,2-a]pyridine
CID 717644
2-(4-Bromophenyl)-3-methylimidazo[1,2-a]pyridine
CID 852495
6-Bromo-3-methylimidazo(1,2-a)pyridine
CID 23537418
4-[(3-Bromophenyl)amino]-6-[[3-(1-imidazolyl)propyl]-amino]pyrido[3,4-d]pyrimidine
CID 5328368
5-(5-Bromo-2-chloropyrimidin-4-yl)pyrrolo[3,2-d]pyrimidine
CID 164575899
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CID 70695756

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine?
The IUPAC name of 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine (CID 69218432) is 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine.
What is the SMILES notation for 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine?
The canonical SMILES for 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine is Brc1cn(-c2ccccn2)c2cnccc12.
What is the InChIKey of 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine?
The InChIKey is DYTUBYDMORFIQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrN3/c13-10-8-16(12-3-1-2-5-15-12)11-7-14-6-4-9(10)11/h1-8H.
What are the key properties of 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine?
3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine has a molecular weight of 274.12 g/mol, XLogP of 3.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-1-pyridin-2-ylpyrrolo[2,3-c]pyridine is sourced from PubChem (CID 69218432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).