6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine

C15H14BrN3O — CID 79955847

IUPAC6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine
SMILESCC(C)c1ccccc1Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C15H14BrN3O/c1-10(2)11-5-3-4-6-12(11)20-15-14-17-7-8-19(14)9-13(16)18-15/h3-10H,1-2H3
InChIKeyJIEWLWWAMXEBEW-UHFFFAOYSA-N
MW332.20 g/mol
LogP4.41
Rot. Bonds3

About 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine

6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine (PubChem CID 79955847) has the molecular formula C15H14BrN3O and a molecular weight of 332.20 g/mol. Its IUPAC name is 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine
PubChem CID79955847
Molecular FormulaC15H14BrN3O
Molecular Weight332.20 g/mol
Exact Mass331.03
IUPAC Name6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine
SMILESCC(C)c1ccccc1Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C15H14BrN3O/c1-10(2)11-5-3-4-6-12(11)20-15-14-17-7-8-19(14)9-13(16)18-15/h3-10H,1-2H3
InChIKeyJIEWLWWAMXEBEW-UHFFFAOYSA-N
XLogP4.41
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.20
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine (CID 79955847) is 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine is CC(C)c1ccccc1Oc1nc(Br)cn2ccnc12.
What is the InChIKey of 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine?
The InChIKey is JIEWLWWAMXEBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O/c1-10(2)11-5-3-4-6-12(11)20-15-14-17-7-8-19(14)9-13(16)18-15/h3-10H,1-2H3.
What are the key properties of 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine?
6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine has a molecular weight of 332.20 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 79955847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).