6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine

C11H11BrN6O — CID 106419770

IUPAC6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
SMILESCc1noc(CCn2c(N)nc3cc(Br)cnc32)n1
InChIInChI=1S/C11H11BrN6O/c1-6-15-9(19-17-6)2-3-18-10-8(16-11(18)13)4-7(12)5-14-10/h4-5H,2-3H2,1H3,(H2,13,16)
InChIKeyINMZGWYQUXEURC-UHFFFAOYSA-N
MW323.15 g/mol
LogP1.71
Rot. Bonds3

About 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine

6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine (PubChem CID 106419770) has the molecular formula C11H11BrN6O and a molecular weight of 323.15 g/mol. Its IUPAC name is 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
PubChem CID106419770
Molecular FormulaC11H11BrN6O
Molecular Weight323.15 g/mol
Exact Mass322.02
IUPAC Name6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
SMILESCc1noc(CCn2c(N)nc3cc(Br)cnc32)n1
InChIInChI=1S/C11H11BrN6O/c1-6-15-9(19-17-6)2-3-18-10-8(16-11(18)13)4-7(12)5-14-10/h4-5H,2-3H2,1H3,(H2,13,16)
InChIKeyINMZGWYQUXEURC-UHFFFAOYSA-N
XLogP1.71
TPSA95.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.15
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine with MolForge

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Related Compounds

5-[2-[6-bromo-2-(chloromethyl)imidazo[4,5-b]pyridin-3-yl]ethyl]-3-methyl-1,2,4-oxadiazole
CID 106420373
6-bromo-3-(2-thiophen-2-ylethyl)imidazo[4,5-b]pyridin-2-amine
CID 79306336
5-fluoro-6-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzimidazol-2-amine
CID 106419721
6-bromo-3-[3-(dimethylamino)propyl]imidazo[4,5-b]pyridin-2-amine
CID 79305894
6-bromo-3-(4-methylsulfanylbutyl)imidazo[4,5-b]pyridin-2-amine
CID 113487873
6-bromo-3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 79306856
6-fluoro-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzimidazol-2-amine
CID 106419732
6-bromo-3-[(2-methyl-1,3-thiazol-5-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 79306867
6-bromo-3-(3-phenoxypropyl)imidazo[4,5-b]pyridin-2-amine
CID 79279143
6-bromo-3-[(1-methylpyrazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 79306206
6-bromo-3-[(1-methylimidazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 79306721
6-bromo-3-(oxan-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 79305908

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine (CID 106419770) is 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine is Cc1noc(CCn2c(N)nc3cc(Br)cnc32)n1.
What is the InChIKey of 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The InChIKey is INMZGWYQUXEURC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN6O/c1-6-15-9(19-17-6)2-3-18-10-8(16-11(18)13)4-7(12)5-14-10/h4-5H,2-3H2,1H3,(H2,13,16).
What are the key properties of 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine has a molecular weight of 323.15 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 106419770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).