6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

C16H16BrN3O — CID 79041465

IUPAC6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(-c2nc3ccc(Br)c(C)n3c2N)cc1C
InChIInChI=1S/C16H16BrN3O/c1-9-8-11(4-6-13(9)21-3)15-16(18)20-10(2)12(17)5-7-14(20)19-15/h4-8H,18H2,1-3H3
InChIKeyFFIQFFHHJQZOJL-UHFFFAOYSA-N
MW346.23 g/mol
LogP3.97
Rot. Bonds2

About 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 79041465) has the molecular formula C16H16BrN3O and a molecular weight of 346.23 g/mol. Its IUPAC name is 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID79041465
Molecular FormulaC16H16BrN3O
Molecular Weight346.23 g/mol
Exact Mass345.05
IUPAC Name6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(-c2nc3ccc(Br)c(C)n3c2N)cc1C
InChIInChI=1S/C16H16BrN3O/c1-9-8-11(4-6-13(9)21-3)15-16(18)20-10(2)12(17)5-7-14(20)19-15/h4-8H,18H2,1-3H3
InChIKeyFFIQFFHHJQZOJL-UHFFFAOYSA-N
XLogP3.97
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.23
LogP ≤ 53.97
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-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (CID 79041465) is 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is COc1ccc(-c2nc3ccc(Br)c(C)n3c2N)cc1C.
What is the InChIKey of 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is FFIQFFHHJQZOJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrN3O/c1-9-8-11(4-6-13(9)21-3)15-16(18)20-10(2)12(17)5-7-14(20)19-15/h4-8H,18H2,1-3H3.
What are the key properties of 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 346.23 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 79041465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).