8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine

C13H11BrN4 — CID 81311711

IUPAC8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(-c2nc3c(Br)cccn3c2N)nc1
InChIInChI=1S/C13H11BrN4/c1-8-4-5-10(16-7-8)11-12(15)18-6-2-3-9(14)13(18)17-11/h2-7H,15H2,1H3
InChIKeyVRSXKRQLUAWQAF-UHFFFAOYSA-N
MW303.16 g/mol
LogP3.05
Rot. Bonds1

About 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine

8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 81311711) has the molecular formula C13H11BrN4 and a molecular weight of 303.16 g/mol. Its IUPAC name is 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID81311711
Molecular FormulaC13H11BrN4
Molecular Weight303.16 g/mol
Exact Mass302.02
IUPAC Name8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(-c2nc3c(Br)cccn3c2N)nc1
InChIInChI=1S/C13H11BrN4/c1-8-4-5-10(16-7-8)11-12(15)18-6-2-3-9(14)13(18)17-11/h2-7H,15H2,1H3
InChIKeyVRSXKRQLUAWQAF-UHFFFAOYSA-N
XLogP3.05
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine (CID 81311711) is 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine is Cc1ccc(-c2nc3c(Br)cccn3c2N)nc1.
What is the InChIKey of 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is VRSXKRQLUAWQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrN4/c1-8-4-5-10(16-7-8)11-12(15)18-6-2-3-9(14)13(18)17-11/h2-7H,15H2,1H3.
What are the key properties of 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine?
8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 303.16 g/mol, XLogP of 3.05, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 81311711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).