5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one

C7H6BrN3O — CID 118022599

IUPAC5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one
SMILESCn1cc(Br)n2cncc2c1=O
InChIInChI=1S/C7H6BrN3O/c1-10-3-6(8)11-4-9-2-5(11)7(10)12/h2-4H,1H3
InChIKeyFJNTVUBILUHGPC-UHFFFAOYSA-N
MW228.05 g/mol
LogP0.80
Rot. Bonds

About 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one

5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one (PubChem CID 118022599) has the molecular formula C7H6BrN3O and a molecular weight of 228.05 g/mol. Its IUPAC name is 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one
PubChem CID118022599
Molecular FormulaC7H6BrN3O
Molecular Weight228.05 g/mol
Exact Mass226.97
IUPAC Name5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one
SMILESCn1cc(Br)n2cncc2c1=O
InChIInChI=1S/C7H6BrN3O/c1-10-3-6(8)11-4-9-2-5(11)7(10)12/h2-4H,1H3
InChIKeyFJNTVUBILUHGPC-UHFFFAOYSA-N
XLogP0.80
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.05
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-1H-imidazole-5-carboxamide
CID 2736884
5H,6H,7H,8H-imidazo(1,5-a)pyrazin-8-one
CID 55276476
7H,8H-imidazo[1,5-a]pyrazin-8-one
CID 308341
N-Methyl-1H-imidazole-4-carboxamide
CID 565659
2-bromo-1-methyl-1H-imidazole-5-carbaldehyde
CID 12742277
3-methyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazin-8-one
CID 58970104
5-bromo-7H,8H-imidazo(1,5-a)pyrazin-8-one
CID 71414471
3-bromo-7H,8H-imidazo[1,5-a]pyrazin-8-one
CID 83382740
7H,8H-imidazo[1,5-a]pyrazin-8-one hydrochloride
CID 164523227
7-acetyl-N,N-dimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
CID 97468765
3-bromo-7H,8H-imidazo(1,5-a)pyrazin-8-one hydrochloride
CID 134690915
N-Methyl-N-propyl-5H,6H,7H,8H-imidazo[1,2-A]pyridine-2-carboxamide
CID 71835803

Frequently Asked Questions

What is the IUPAC name of 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one?
The IUPAC name of 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one (CID 118022599) is 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one.
What is the SMILES notation for 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one?
The canonical SMILES for 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one is Cn1cc(Br)n2cncc2c1=O.
What is the InChIKey of 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one?
The InChIKey is FJNTVUBILUHGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3O/c1-10-3-6(8)11-4-9-2-5(11)7(10)12/h2-4H,1H3.
What are the key properties of 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one?
5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one has a molecular weight of 228.05 g/mol, XLogP of 0.80, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-7-methylimidazo[1,5-a]pyrazin-8-one is sourced from PubChem (CID 118022599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).