2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine

C11H9BrN4O — CID 79820993

IUPAC2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCNc1ccc2[nH]c(-c3ccc(Br)o3)nc2n1
InChIInChI=1S/C11H9BrN4O/c1-13-9-5-2-6-10(15-9)16-11(14-6)7-3-4-8(12)17-7/h2-5H,1H3,(H2,13,14,15,16)
InChIKeyZVGASFDIXATZOH-UHFFFAOYSA-N
MW293.12 g/mol
LogP3.02
Rot. Bonds2

About 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine

2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79820993) has the molecular formula C11H9BrN4O and a molecular weight of 293.12 g/mol. Its IUPAC name is 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79820993
Molecular FormulaC11H9BrN4O
Molecular Weight293.12 g/mol
Exact Mass292.00
IUPAC Name2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCNc1ccc2[nH]c(-c3ccc(Br)o3)nc2n1
InChIInChI=1S/C11H9BrN4O/c1-13-9-5-2-6-10(15-9)16-11(14-6)7-3-4-8(12)17-7/h2-5H,1H3,(H2,13,14,15,16)
InChIKeyZVGASFDIXATZOH-UHFFFAOYSA-N
XLogP3.02
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.12
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine (CID 79820993) is 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine is CNc1ccc2[nH]c(-c3ccc(Br)o3)nc2n1.
What is the InChIKey of 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is ZVGASFDIXATZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN4O/c1-13-9-5-2-6-10(15-9)16-11(14-6)7-3-4-8(12)17-7/h2-5H,1H3,(H2,13,14,15,16).
What are the key properties of 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 293.12 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromofuran-2-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79820993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).