2-bromo-6-methoxyimidazo[1,2-a]pyrazine

C7H6BrN3O — CID 84691646

IUPAC2-bromo-6-methoxyimidazo[1,2-a]pyrazine
SMILESCOc1cn2cc(Br)nc2cn1
InChIInChI=1S/C7H6BrN3O/c1-12-7-4-11-3-5(8)10-6(11)2-9-7/h2-4H,1H3
InChIKeyQJPDHSGUKDFZNX-UHFFFAOYSA-N
MW228.05 g/mol
LogP1.50
Rot. Bonds1

About 2-bromo-6-methoxyimidazo[1,2-a]pyrazine

2-bromo-6-methoxyimidazo[1,2-a]pyrazine (PubChem CID 84691646) has the molecular formula C7H6BrN3O and a molecular weight of 228.05 g/mol. Its IUPAC name is 2-bromo-6-methoxyimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-bromo-6-methoxyimidazo[1,2-a]pyrazine
PubChem CID84691646
Molecular FormulaC7H6BrN3O
Molecular Weight228.05 g/mol
Exact Mass226.97
IUPAC Name2-bromo-6-methoxyimidazo[1,2-a]pyrazine
SMILESCOc1cn2cc(Br)nc2cn1
InChIInChI=1S/C7H6BrN3O/c1-12-7-4-11-3-5(8)10-6(11)2-9-7/h2-4H,1H3
InChIKeyQJPDHSGUKDFZNX-UHFFFAOYSA-N
XLogP1.50
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.05
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-methoxyimidazo[1,2-a]pyrazine?
The IUPAC name of 2-bromo-6-methoxyimidazo[1,2-a]pyrazine (CID 84691646) is 2-bromo-6-methoxyimidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-bromo-6-methoxyimidazo[1,2-a]pyrazine?
The canonical SMILES for 2-bromo-6-methoxyimidazo[1,2-a]pyrazine is COc1cn2cc(Br)nc2cn1.
What is the InChIKey of 2-bromo-6-methoxyimidazo[1,2-a]pyrazine?
The InChIKey is QJPDHSGUKDFZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3O/c1-12-7-4-11-3-5(8)10-6(11)2-9-7/h2-4H,1H3.
What are the key properties of 2-bromo-6-methoxyimidazo[1,2-a]pyrazine?
2-bromo-6-methoxyimidazo[1,2-a]pyrazine has a molecular weight of 228.05 g/mol, XLogP of 1.50, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-methoxyimidazo[1,2-a]pyrazine is sourced from PubChem (CID 84691646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).