2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine

C15H14BrN3O2 — CID 135335295

IUPAC2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine
SMILESCOc1cc(OC)c(-c2cn3ccc(N)cc3n2)cc1Br
InChIInChI=1S/C15H14BrN3O2/c1-20-13-7-14(21-2)11(16)6-10(13)12-8-19-4-3-9(17)5-15(19)18-12/h3-8H,17H2,1-2H3
InChIKeyHFWXRGJHKHPTFI-UHFFFAOYSA-N
MW348.20 g/mol
LogP3.36
Rot. Bonds3

About 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine

2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine (PubChem CID 135335295) has the molecular formula C15H14BrN3O2 and a molecular weight of 348.20 g/mol. Its IUPAC name is 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine.

Molecular Properties

Compound Name2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine
PubChem CID135335295
Molecular FormulaC15H14BrN3O2
Molecular Weight348.20 g/mol
Exact Mass347.03
IUPAC Name2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine
SMILESCOc1cc(OC)c(-c2cn3ccc(N)cc3n2)cc1Br
InChIInChI=1S/C15H14BrN3O2/c1-20-13-7-14(21-2)11(16)6-10(13)12-8-19-4-3-9(17)5-15(19)18-12/h3-8H,17H2,1-2H3
InChIKeyHFWXRGJHKHPTFI-UHFFFAOYSA-N
XLogP3.36
TPSA61.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.20
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine?
The IUPAC name of 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine (CID 135335295) is 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine.
What is the SMILES notation for 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine?
The canonical SMILES for 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine is COc1cc(OC)c(-c2cn3ccc(N)cc3n2)cc1Br.
What is the InChIKey of 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine?
The InChIKey is HFWXRGJHKHPTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O2/c1-20-13-7-14(21-2)11(16)6-10(13)12-8-19-4-3-9(17)5-15(19)18-12/h3-8H,17H2,1-2H3.
What are the key properties of 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine?
2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine has a molecular weight of 348.20 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-amine is sourced from PubChem (CID 135335295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).