(6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol

C8H8BrN3O2 — CID 11777256

IUPAC(6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol
SMILESCOc1nc(Br)cn2c(CO)cnc12
InChIInChI=1S/C8H8BrN3O2/c1-14-8-7-10-2-5(4-13)12(7)3-6(9)11-8/h2-3,13H,4H2,1H3
InChIKeyUGMYRYRPKMELKL-UHFFFAOYSA-N
MW258.07 g/mol
LogP0.99
Rot. Bonds2

About (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol

(6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol (PubChem CID 11777256) has the molecular formula C8H8BrN3O2 and a molecular weight of 258.07 g/mol. Its IUPAC name is (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol.

Molecular Properties

Compound Name(6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol
PubChem CID11777256
Molecular FormulaC8H8BrN3O2
Molecular Weight258.07 g/mol
Exact Mass256.98
IUPAC Name(6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol
SMILESCOc1nc(Br)cn2c(CO)cnc12
InChIInChI=1S/C8H8BrN3O2/c1-14-8-7-10-2-5(4-13)12(7)3-6(9)11-8/h2-3,13H,4H2,1H3
InChIKeyUGMYRYRPKMELKL-UHFFFAOYSA-N
XLogP0.99
TPSA59.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.07
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol?
The IUPAC name of (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol (CID 11777256) is (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol.
What is the SMILES notation for (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol?
The canonical SMILES for (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol is COc1nc(Br)cn2c(CO)cnc12.
What is the InChIKey of (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol?
The InChIKey is UGMYRYRPKMELKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrN3O2/c1-14-8-7-10-2-5(4-13)12(7)3-6(9)11-8/h2-3,13H,4H2,1H3.
What are the key properties of (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol?
(6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol has a molecular weight of 258.07 g/mol, XLogP of 0.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-8-methoxyimidazo[1,2-a]pyrazin-3-yl)methanol is sourced from PubChem (CID 11777256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).