6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine

C20H21BrN6O — CID 155568186

IUPAC6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESBrc1ccc2nc(-c3ccc4nccn4c3)c(NCCN3CCOCC3)n2c1
InChIInChI=1S/C20H21BrN6O/c21-16-2-4-18-24-19(15-1-3-17-22-6-8-26(17)13-15)20(27(18)14-16)23-5-7-25-9-11-28-12-10-25/h1-4,6,8,13-14,23H,5,7,9-12H2
InChIKeyRWOKDOFAEGLMFO-UHFFFAOYSA-N
MW441.33 g/mol
LogP3.16
Rot. Bonds5

About 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine

6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 155568186) has the molecular formula C20H21BrN6O and a molecular weight of 441.33 g/mol. Its IUPAC name is 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID155568186
Molecular FormulaC20H21BrN6O
Molecular Weight441.33 g/mol
Exact Mass440.10
IUPAC Name6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESBrc1ccc2nc(-c3ccc4nccn4c3)c(NCCN3CCOCC3)n2c1
InChIInChI=1S/C20H21BrN6O/c21-16-2-4-18-24-19(15-1-3-17-22-6-8-26(17)13-15)20(27(18)14-16)23-5-7-25-9-11-28-12-10-25/h1-4,6,8,13-14,23H,5,7,9-12H2
InChIKeyRWOKDOFAEGLMFO-UHFFFAOYSA-N
XLogP3.16
TPSA59.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine (CID 155568186) is 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine is Brc1ccc2nc(-c3ccc4nccn4c3)c(NCCN3CCOCC3)n2c1.
What is the InChIKey of 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is RWOKDOFAEGLMFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21BrN6O/c21-16-2-4-18-24-19(15-1-3-17-22-6-8-26(17)13-15)20(27(18)14-16)23-5-7-25-9-11-28-12-10-25/h1-4,6,8,13-14,23H,5,7,9-12H2.
What are the key properties of 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 441.33 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 155568186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).