2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine

C12H10BrN3O — CID 104654247

IUPAC2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine
SMILESCc1cc(C)n2cc(-c3ccc(Br)o3)nc2n1
InChIInChI=1S/C12H10BrN3O/c1-7-5-8(2)16-6-9(15-12(16)14-7)10-3-4-11(13)17-10/h3-6H,1-2H3
InChIKeySYCUXSCDLHPONH-UHFFFAOYSA-N
MW292.14 g/mol
LogP3.37
Rot. Bonds1

About 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine

2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine (PubChem CID 104654247) has the molecular formula C12H10BrN3O and a molecular weight of 292.14 g/mol. Its IUPAC name is 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine
PubChem CID104654247
Molecular FormulaC12H10BrN3O
Molecular Weight292.14 g/mol
Exact Mass291.00
IUPAC Name2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine
SMILESCc1cc(C)n2cc(-c3ccc(Br)o3)nc2n1
InChIInChI=1S/C12H10BrN3O/c1-7-5-8(2)16-6-9(15-12(16)14-7)10-3-4-11(13)17-10/h3-6H,1-2H3
InChIKeySYCUXSCDLHPONH-UHFFFAOYSA-N
XLogP3.37
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.14
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine (CID 104654247) is 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine is Cc1cc(C)n2cc(-c3ccc(Br)o3)nc2n1.
What is the InChIKey of 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
The InChIKey is SYCUXSCDLHPONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3O/c1-7-5-8(2)16-6-9(15-12(16)14-7)10-3-4-11(13)17-10/h3-6H,1-2H3.
What are the key properties of 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine has a molecular weight of 292.14 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 104654247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).