[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol

C13H10BrN3O2 — CID 79955672

IUPAC[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
SMILESOCc1ccccc1Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C13H10BrN3O2/c14-11-7-17-6-5-15-12(17)13(16-11)19-10-4-2-1-3-9(10)8-18/h1-7,18H,8H2
InChIKeyYRVCRUCCVJOKDY-UHFFFAOYSA-N
MW320.15 g/mol
LogP2.78
Rot. Bonds3

About [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol

[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol (PubChem CID 79955672) has the molecular formula C13H10BrN3O2 and a molecular weight of 320.15 g/mol. Its IUPAC name is [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol.

Molecular Properties

Compound Name[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
PubChem CID79955672
Molecular FormulaC13H10BrN3O2
Molecular Weight320.15 g/mol
Exact Mass319.00
IUPAC Name[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
SMILESOCc1ccccc1Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C13H10BrN3O2/c14-11-7-17-6-5-15-12(17)13(16-11)19-10-4-2-1-3-9(10)8-18/h1-7,18H,8H2
InChIKeyYRVCRUCCVJOKDY-UHFFFAOYSA-N
XLogP2.78
TPSA59.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.15
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
The IUPAC name of [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol (CID 79955672) is [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol.
What is the SMILES notation for [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
The canonical SMILES for [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol is OCc1ccccc1Oc1nc(Br)cn2ccnc12.
What is the InChIKey of [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
The InChIKey is YRVCRUCCVJOKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN3O2/c14-11-7-17-6-5-15-12(17)13(16-11)19-10-4-2-1-3-9(10)8-18/h1-7,18H,8H2.
What are the key properties of [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol has a molecular weight of 320.15 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol is sourced from PubChem (CID 79955672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).