1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane

C9H11BrClN3 — CID 145329681

IUPAC1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane
SMILESCC.Cc1nc(Br)c2c(Cl)nccn12
InChIInChI=1S/C7H5BrClN3.C2H6/c1-4-11-6(8)5-7(9)10-2-3-12(4)5;1-2/h2-3H,1H3;1-2H3
InChIKeyFYAXDLUXKDSBAO-UHFFFAOYSA-N
MW276.57 g/mol
LogP3.48
Rot. Bonds

About 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane

1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane (PubChem CID 145329681) has the molecular formula C9H11BrClN3 and a molecular weight of 276.57 g/mol. Its IUPAC name is 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane.

Molecular Properties

Compound Name1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane
PubChem CID145329681
Molecular FormulaC9H11BrClN3
Molecular Weight276.57 g/mol
Exact Mass274.98
IUPAC Name1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane
SMILESCC.Cc1nc(Br)c2c(Cl)nccn12
InChIInChI=1S/C7H5BrClN3.C2H6/c1-4-11-6(8)5-7(9)10-2-3-12(4)5;1-2/h2-3H,1H3;1-2H3
InChIKeyFYAXDLUXKDSBAO-UHFFFAOYSA-N
XLogP3.48
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.57
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-(1-bromo-8-chloroimidazo[1,5-a]pyrazin-3-yl)acetate
CID 145429533
(4aR,7R)-7-(1-bromo-8-chloroimidazo[1,5-a]pyrazin-3-yl)-2-methyl-4,4a,5,6,7,8-hexahydro-3H-pyrido[1,2-c]pyrimidin-1-one
CID 90283041
1-bromo-3-(2-chloro-6-fluorophenyl)-8-methoxyimidazo[1,5-a]pyrazine
CID 167130655
8-amino-1-bromoimidazo[1,5-a]pyrazine-3-thiolate;ethane;rubidium(1+)
CID 172620935
(6R,8aS)-6-(1-bromo-8-chloroimidazo[1,5-a]pyrazin-3-yl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-[1,3]oxazolo[3,4-a]pyridin-3-one
CID 86727794
1-bromo-7-chloro-3-methylimidazo[1,5-a]pyridine
CID 83900011
8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine
CID 143744436
CID 157137100
CID 157137100
8-chloro-5,6-dimethylimidazo[1,2-a]pyrazine
CID 171820934
8-chloro-1-ethyl-3-propan-2-ylimidazo[1,5-a]pyrazine
CID 123649523
1-ethyl-3-methylimidazo[1,5-a]pyrazin-8-amine
CID 166808466
2-(1-bromo-3-methyl-8-oxoimidazo[1,5-a]pyrazin-7-yl)acetaldehyde
CID 154954918

Frequently Asked Questions

What is the IUPAC name of 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane?
The IUPAC name of 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane (CID 145329681) is 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane.
What is the SMILES notation for 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane?
The canonical SMILES for 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane is CC.Cc1nc(Br)c2c(Cl)nccn12.
What is the InChIKey of 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane?
The InChIKey is FYAXDLUXKDSBAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrClN3.C2H6/c1-4-11-6(8)5-7(9)10-2-3-12(4)5;1-2/h2-3H,1H3;1-2H3.
What are the key properties of 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane?
1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane has a molecular weight of 276.57 g/mol, XLogP of 3.48, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-8-chloro-3-methylimidazo[1,5-a]pyrazine;ethane is sourced from PubChem (CID 145329681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).