6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine

C13H10Br2N4O — CID 79302159

IUPAC6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc(Br)c(-n2c(N)nc3cc(Br)cnc32)c1
InChIInChI=1S/C13H10Br2N4O/c1-20-8-2-3-9(15)11(5-8)19-12-10(18-13(19)16)4-7(14)6-17-12/h2-6H,1H3,(H2,16,18)
InChIKeyBUNPRIDSQYYJML-UHFFFAOYSA-N
MW398.06 g/mol
LogP3.54
Rot. Bonds2

About 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine

6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 79302159) has the molecular formula C13H10Br2N4O and a molecular weight of 398.06 g/mol. Its IUPAC name is 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID79302159
Molecular FormulaC13H10Br2N4O
Molecular Weight398.06 g/mol
Exact Mass395.92
IUPAC Name6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc(Br)c(-n2c(N)nc3cc(Br)cnc32)c1
InChIInChI=1S/C13H10Br2N4O/c1-20-8-2-3-9(15)11(5-8)19-12-10(18-13(19)16)4-7(14)6-17-12/h2-6H,1H3,(H2,16,18)
InChIKeyBUNPRIDSQYYJML-UHFFFAOYSA-N
XLogP3.54
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.06
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-bromo-3-(4-methoxy-2-methylphenyl)imidazo[4,5-b]pyridin-2-amine
CID 79306649
6-bromo-3-(2-bromo-5-methoxyphenyl)-2-(chloromethyl)imidazo[4,5-b]pyridine
CID 79278638
6-bromo-3-[2-(methoxymethyl)phenyl]imidazo[4,5-b]pyridin-2-amine
CID 79306056
6-bromo-3-(2,4,5-trichlorophenyl)imidazo[4,5-b]pyridin-2-amine
CID 79306931
6-chloro-3-(2,4-dibromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine
CID 103415767
6-bromo-3-(4-ethylphenyl)imidazo[4,5-b]pyridin-2-amine
CID 79306193
6-bromo-2-(chloromethyl)-3-(3-methoxyphenyl)imidazo[4,5-b]pyridine
CID 79301892
6-bromo-3-(4-methylsulfonylphenyl)imidazo[4,5-b]pyridin-2-amine
CID 79280401
3-(2-bromo-5-fluorophenyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 107637413
3-(2,5-dibromophenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
CID 81138625
3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
CID 81141726
3-bromo-7-methoxyquinoline
CID 18788548

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine (CID 79302159) is 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine is COc1ccc(Br)c(-n2c(N)nc3cc(Br)cnc32)c1.
What is the InChIKey of 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is BUNPRIDSQYYJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Br2N4O/c1-20-8-2-3-9(15)11(5-8)19-12-10(18-13(19)16)4-7(14)6-17-12/h2-6H,1H3,(H2,16,18).
What are the key properties of 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine?
6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 398.06 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(2-bromo-5-methoxyphenyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 79302159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).