6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine

C12H8Br3N3O — CID 83170495

IUPAC6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cc(Br)cn2c(N)c(-c3cc(Br)c(Br)o3)nc12
InChIInChI=1S/C12H8Br3N3O/c1-5-2-6(13)4-18-11(16)9(17-12(5)18)8-3-7(14)10(15)19-8/h2-4H,16H2,1H3
InChIKeyBICYBDVANRJZPF-UHFFFAOYSA-N
MW449.93 g/mol
LogP4.77
Rot. Bonds1

About 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine

6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 83170495) has the molecular formula C12H8Br3N3O and a molecular weight of 449.93 g/mol. Its IUPAC name is 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID83170495
Molecular FormulaC12H8Br3N3O
Molecular Weight449.93 g/mol
Exact Mass446.82
IUPAC Name6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cc(Br)cn2c(N)c(-c3cc(Br)c(Br)o3)nc12
InChIInChI=1S/C12H8Br3N3O/c1-5-2-6(13)4-18-11(16)9(17-12(5)18)8-3-7(14)10(15)19-8/h2-4H,16H2,1H3
InChIKeyBICYBDVANRJZPF-UHFFFAOYSA-N
XLogP4.77
TPSA56.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.93
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine (CID 83170495) is 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine is Cc1cc(Br)cn2c(N)c(-c3cc(Br)c(Br)o3)nc12.
What is the InChIKey of 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is BICYBDVANRJZPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Br3N3O/c1-5-2-6(13)4-18-11(16)9(17-12(5)18)8-3-7(14)10(15)19-8/h2-4H,16H2,1H3.
What are the key properties of 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine?
6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 449.93 g/mol, XLogP of 4.77, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 83170495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).