5-bromo-2-pyrrol-1-ylpyridine

C9H7BrN2 — CID 2797792

IUPAC5-bromo-2-pyrrol-1-ylpyridine
SMILESBrc1ccc(-n2cccc2)nc1
InChIInChI=1S/C9H7BrN2/c10-8-3-4-9(11-7-8)12-5-1-2-6-12/h1-7H
InChIKeyFFSASABTRPXORW-UHFFFAOYSA-N
MW223.07 g/mol
LogP2.63
Rot. Bonds1

About 5-bromo-2-pyrrol-1-ylpyridine

5-bromo-2-pyrrol-1-ylpyridine (PubChem CID 2797792) has the molecular formula C9H7BrN2 and a molecular weight of 223.07 g/mol. Its IUPAC name is 5-bromo-2-pyrrol-1-ylpyridine.

Molecular Properties

Compound Name5-bromo-2-pyrrol-1-ylpyridine
PubChem CID2797792
Molecular FormulaC9H7BrN2
Molecular Weight223.07 g/mol
Exact Mass221.98
IUPAC Name5-bromo-2-pyrrol-1-ylpyridine
SMILESBrc1ccc(-n2cccc2)nc1
InChIInChI=1S/C9H7BrN2/c10-8-3-4-9(11-7-8)12-5-1-2-6-12/h1-7H
InChIKeyFFSASABTRPXORW-UHFFFAOYSA-N
XLogP2.63
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.07
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-bromo-2-pyrrol-1-ylpyridine with MolForge

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

Launch Full Analysis

Related Compounds

2-Amino-5-bromopyridine
CID 70622
2-Dimethylaminopyridine
CID 21885
3-Bromoimidazo[1,2-a]pyridine
CID 327951
6-Bromo-8-methylimidazo(1,2-a)pyridine
CID 5260647
2-Amino-3-bromopyridine
CID 817700
1-(5-Bromopyridin-2-yl)piperazine
CID 16414227
3,5-Dibromo-2-pyridylamine
CID 98851
6-Bromo-3-methylimidazo(1,2-a)pyridine
CID 23537418
5-bromo-2-(2,5-dimethyl-1H-pyrrol-1-yl)pyrimidine
CID 3276508
1-(3-Bromopyridin-2-yl)-4-methylpiperazine
CID 12203911
1-(3-Bromopyridin-2-yl)piperazine
CID 13298529
2-Bromo-3-imidazol-1-ylmethyl-pyridine
CID 57329866

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-pyrrol-1-ylpyridine?
The IUPAC name of 5-bromo-2-pyrrol-1-ylpyridine (CID 2797792) is 5-bromo-2-pyrrol-1-ylpyridine.
What is the SMILES notation for 5-bromo-2-pyrrol-1-ylpyridine?
The canonical SMILES for 5-bromo-2-pyrrol-1-ylpyridine is Brc1ccc(-n2cccc2)nc1.
What is the InChIKey of 5-bromo-2-pyrrol-1-ylpyridine?
The InChIKey is FFSASABTRPXORW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2/c10-8-3-4-9(11-7-8)12-5-1-2-6-12/h1-7H.
What are the key properties of 5-bromo-2-pyrrol-1-ylpyridine?
5-bromo-2-pyrrol-1-ylpyridine has a molecular weight of 223.07 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-pyrrol-1-ylpyridine is sourced from PubChem (CID 2797792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).