3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine

C8H8BrN3 — CID 153124401

IUPAC3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine
SMILESCc1nc2c(C)nccn2c1Br
InChIInChI=1S/C8H8BrN3/c1-5-7(9)12-4-3-10-6(2)8(12)11-5/h3-4H,1-2H3
InChIKeyVVMUIGUDLAECQS-UHFFFAOYSA-N
MW226.08 g/mol
LogP2.11
Rot. Bonds

About 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine

3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine (PubChem CID 153124401) has the molecular formula C8H8BrN3 and a molecular weight of 226.08 g/mol. Its IUPAC name is 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine
PubChem CID153124401
Molecular FormulaC8H8BrN3
Molecular Weight226.08 g/mol
Exact Mass224.99
IUPAC Name3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine
SMILESCc1nc2c(C)nccn2c1Br
InChIInChI=1S/C8H8BrN3/c1-5-7(9)12-4-3-10-6(2)8(12)11-5/h3-4H,1-2H3
InChIKeyVVMUIGUDLAECQS-UHFFFAOYSA-N
XLogP2.11
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.08
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine?
The IUPAC name of 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine (CID 153124401) is 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine?
The canonical SMILES for 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine is Cc1nc2c(C)nccn2c1Br.
What is the InChIKey of 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine?
The InChIKey is VVMUIGUDLAECQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrN3/c1-5-7(9)12-4-3-10-6(2)8(12)11-5/h3-4H,1-2H3.
What are the key properties of 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine?
3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine has a molecular weight of 226.08 g/mol, XLogP of 2.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2,8-dimethylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 153124401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).