(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

C11H10BrN3O2 — CID 55143260

IUPAC(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESO=C(c1ccc(Br)o1)N1CCn2ccnc2C1
InChIInChI=1S/C11H10BrN3O2/c12-9-2-1-8(17-9)11(16)15-6-5-14-4-3-13-10(14)7-15/h1-4H,5-7H2
InChIKeyOKKKHYOJVNCAHR-UHFFFAOYSA-N
MW296.12 g/mol
LogP1.89
Rot. Bonds1

About (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (PubChem CID 55143260) has the molecular formula C11H10BrN3O2 and a molecular weight of 296.12 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
PubChem CID55143260
Molecular FormulaC11H10BrN3O2
Molecular Weight296.12 g/mol
Exact Mass295.00
IUPAC Name(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESO=C(c1ccc(Br)o1)N1CCn2ccnc2C1
InChIInChI=1S/C11H10BrN3O2/c12-9-2-1-8(17-9)11(16)15-6-5-14-4-3-13-10(14)7-15/h1-4H,5-7H2
InChIKeyOKKKHYOJVNCAHR-UHFFFAOYSA-N
XLogP1.89
TPSA51.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.12
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The IUPAC name of (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (CID 55143260) is (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.
What is the SMILES notation for (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The canonical SMILES for (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is O=C(c1ccc(Br)o1)N1CCn2ccnc2C1.
What is the InChIKey of (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The InChIKey is OKKKHYOJVNCAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrN3O2/c12-9-2-1-8(17-9)11(16)15-6-5-14-4-3-13-10(14)7-15/h1-4H,5-7H2.
What are the key properties of (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone has a molecular weight of 296.12 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is sourced from PubChem (CID 55143260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).