2-bromo-5-methylpyrrolo[2,3-b]pyrazine

C7H6BrN3 — CID 52987641

IUPAC2-bromo-5-methylpyrrolo[2,3-b]pyrazine
SMILESCn1ccc2nc(Br)cnc21
InChIInChI=1S/C7H6BrN3/c1-11-3-2-5-7(11)9-4-6(8)10-5/h2-4H,1H3
InChIKeyHCNWBBQXABEWMZ-UHFFFAOYSA-N
MW212.05 g/mol
LogP1.73
Rot. Bonds

About 2-bromo-5-methylpyrrolo[2,3-b]pyrazine

2-bromo-5-methylpyrrolo[2,3-b]pyrazine (PubChem CID 52987641) has the molecular formula C7H6BrN3 and a molecular weight of 212.05 g/mol. Its IUPAC name is 2-bromo-5-methylpyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name2-bromo-5-methylpyrrolo[2,3-b]pyrazine
PubChem CID52987641
Molecular FormulaC7H6BrN3
Molecular Weight212.05 g/mol
Exact Mass210.97
IUPAC Name2-bromo-5-methylpyrrolo[2,3-b]pyrazine
SMILESCn1ccc2nc(Br)cnc21
InChIInChI=1S/C7H6BrN3/c1-11-3-2-5-7(11)9-4-6(8)10-5/h2-4H,1H3
InChIKeyHCNWBBQXABEWMZ-UHFFFAOYSA-N
XLogP1.73
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.05
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5H-Pyrrolo[2,3-b]pyrazine
CID 5370803
2-bromo-7-iodo-5H-pyrrolo(2,3-b)pyrazine
CID 44118277
3-Bromo-4,7-diazaindole
CID 12207193
2-bromo-5H-pyrrolo[2,3-b]pyrazine
CID 25067308
2-Bromo-3-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 70700892
2-bromo-1-methyl-1H-imidazo[4,5-c]pyridine
CID 83835190
5-Chloroimidazo[1,5-c]pyrimidine
CID 84649881
1-Bromo-5-chloroimidazo[1,5-c]pyrimidine
CID 84696184
N,N-dimethyl-1-(3-methylimidazo[1,5-a]pyrazin-1-yl)methanamine
CID 296225
Imidazo(1,5-c)pyrimidine
CID 21083975
2-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 53677348
Pyrrolo[1,2-a]pyrimidin-7-amine
CID 55285074

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-methylpyrrolo[2,3-b]pyrazine?
The IUPAC name of 2-bromo-5-methylpyrrolo[2,3-b]pyrazine (CID 52987641) is 2-bromo-5-methylpyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 2-bromo-5-methylpyrrolo[2,3-b]pyrazine?
The canonical SMILES for 2-bromo-5-methylpyrrolo[2,3-b]pyrazine is Cn1ccc2nc(Br)cnc21.
What is the InChIKey of 2-bromo-5-methylpyrrolo[2,3-b]pyrazine?
The InChIKey is HCNWBBQXABEWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3/c1-11-3-2-5-7(11)9-4-6(8)10-5/h2-4H,1H3.
What are the key properties of 2-bromo-5-methylpyrrolo[2,3-b]pyrazine?
2-bromo-5-methylpyrrolo[2,3-b]pyrazine has a molecular weight of 212.05 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-methylpyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 52987641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).