6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine

C12H14BrN3O — CID 154655093

IUPAC6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine
SMILESCc1nc(Br)cn2cc(C3CCOCC3)nc12
InChIInChI=1S/C12H14BrN3O/c1-8-12-15-10(9-2-4-17-5-3-9)6-16(12)7-11(13)14-8/h6-7,9H,2-5H2,1H3
InChIKeyKLWJYFLRBDQSFU-UHFFFAOYSA-N
MW296.17 g/mol
LogP2.69
Rot. Bonds1

About 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine

6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine (PubChem CID 154655093) has the molecular formula C12H14BrN3O and a molecular weight of 296.17 g/mol. Its IUPAC name is 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine
PubChem CID154655093
Molecular FormulaC12H14BrN3O
Molecular Weight296.17 g/mol
Exact Mass295.03
IUPAC Name6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine
SMILESCc1nc(Br)cn2cc(C3CCOCC3)nc12
InChIInChI=1S/C12H14BrN3O/c1-8-12-15-10(9-2-4-17-5-3-9)6-16(12)7-11(13)14-8/h6-7,9H,2-5H2,1H3
InChIKeyKLWJYFLRBDQSFU-UHFFFAOYSA-N
XLogP2.69
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.17
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 117133635
6-bromo-8-ethoxy-2-(oxan-3-yl)imidazo[1,2-a]pyrazine
CID 155437441
6-bromo-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 155188182
6-chloro-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 117128940
CID 175739360
CID 175739360
8-bromo-2-cyclopropylimidazo[1,2-a]pyridine
CID 79016015
4-bromo-2-chloro-6-(oxan-4-yl)pyrimidine
CID 130056243
N-[8-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154655525
2-methoxy-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]pyridine-3-carboxamide
CID 154655303
2-(oxolan-3-yl)imidazo[1,2-a]pyrazine
CID 104756413
2-cyclohexyl-8-methylimidazo[1,2-a]pyridin-6-amine
CID 112555615
5-bromo-2-(oxolan-3-yl)imidazo[1,2-a]pyridine
CID 117131122

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine (CID 154655093) is 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine is Cc1nc(Br)cn2cc(C3CCOCC3)nc12.
What is the InChIKey of 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine?
The InChIKey is KLWJYFLRBDQSFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3O/c1-8-12-15-10(9-2-4-17-5-3-9)6-16(12)7-11(13)14-8/h6-7,9H,2-5H2,1H3.
What are the key properties of 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine?
6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine has a molecular weight of 296.17 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 154655093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).