2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine

C15H14BrN3O — CID 66480092

IUPAC2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
SMILESCOc1cccn2c(N)c(-c3ccc(Br)c(C)c3)nc12
InChIInChI=1S/C15H14BrN3O/c1-9-8-10(5-6-11(9)16)13-14(17)19-7-3-4-12(20-2)15(19)18-13/h3-8H,17H2,1-2H3
InChIKeySQROHPPKPVSUHV-UHFFFAOYSA-N
MW332.20 g/mol
LogP3.66
Rot. Bonds2

About 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine

2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine (PubChem CID 66480092) has the molecular formula C15H14BrN3O and a molecular weight of 332.20 g/mol. Its IUPAC name is 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
PubChem CID66480092
Molecular FormulaC15H14BrN3O
Molecular Weight332.20 g/mol
Exact Mass331.03
IUPAC Name2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine
SMILESCOc1cccn2c(N)c(-c3ccc(Br)c(C)c3)nc12
InChIInChI=1S/C15H14BrN3O/c1-9-8-10(5-6-11(9)16)13-14(17)19-7-3-4-12(20-2)15(19)18-13/h3-8H,17H2,1-2H3
InChIKeySQROHPPKPVSUHV-UHFFFAOYSA-N
XLogP3.66
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.20
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine (CID 66480092) is 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine is COc1cccn2c(N)c(-c3ccc(Br)c(C)c3)nc12.
What is the InChIKey of 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine?
The InChIKey is SQROHPPKPVSUHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O/c1-9-8-10(5-6-11(9)16)13-14(17)19-7-3-4-12(20-2)15(19)18-13/h3-8H,17H2,1-2H3.
What are the key properties of 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine?
2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine has a molecular weight of 332.20 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-3-methylphenyl)-8-methoxyimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 66480092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).