1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol

C11H14BrN3O2 — CID 156533173

IUPAC1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol
SMILESCc1cn2cc(Br)nc(OCC(C)(C)O)c2n1
InChIInChI=1S/C11H14BrN3O2/c1-7-4-15-5-8(12)14-10(9(15)13-7)17-6-11(2,3)16/h4-5,16H,6H2,1-3H3
InChIKeyAPJOQCWIAYCVTQ-UHFFFAOYSA-N
MW300.16 g/mol
LogP1.95
Rot. Bonds3

About 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol

1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol (PubChem CID 156533173) has the molecular formula C11H14BrN3O2 and a molecular weight of 300.16 g/mol. Its IUPAC name is 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol
PubChem CID156533173
Molecular FormulaC11H14BrN3O2
Molecular Weight300.16 g/mol
Exact Mass299.03
IUPAC Name1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol
SMILESCc1cn2cc(Br)nc(OCC(C)(C)O)c2n1
InChIInChI=1S/C11H14BrN3O2/c1-7-4-15-5-8(12)14-10(9(15)13-7)17-6-11(2,3)16/h4-5,16H,6H2,1-3H3
InChIKeyAPJOQCWIAYCVTQ-UHFFFAOYSA-N
XLogP1.95
TPSA59.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.16
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol?
The IUPAC name of 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol (CID 156533173) is 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol.
What is the SMILES notation for 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol?
The canonical SMILES for 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol is Cc1cn2cc(Br)nc(OCC(C)(C)O)c2n1.
What is the InChIKey of 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol?
The InChIKey is APJOQCWIAYCVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O2/c1-7-4-15-5-8(12)14-10(9(15)13-7)17-6-11(2,3)16/h4-5,16H,6H2,1-3H3.
What are the key properties of 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol?
1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol has a molecular weight of 300.16 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)oxy-2-methylpropan-2-ol is sourced from PubChem (CID 156533173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).