5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine

C11H7BrClN5 — CID 122196555

IUPAC5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
SMILESNc1ncc(Br)cc1-c1nc2ncc(Cl)cc2[nH]1
InChIInChI=1S/C11H7BrClN5/c12-5-1-7(9(14)15-3-5)10-17-8-2-6(13)4-16-11(8)18-10/h1-4H,(H2,14,15)(H,16,17,18)
InChIKeySERGCCVLLRWNTL-UHFFFAOYSA-N
MW324.57 g/mol
LogP3.02
Rot. Bonds1

About 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine

5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine (PubChem CID 122196555) has the molecular formula C11H7BrClN5 and a molecular weight of 324.57 g/mol. Its IUPAC name is 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
PubChem CID122196555
Molecular FormulaC11H7BrClN5
Molecular Weight324.57 g/mol
Exact Mass322.96
IUPAC Name5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
SMILESNc1ncc(Br)cc1-c1nc2ncc(Cl)cc2[nH]1
InChIInChI=1S/C11H7BrClN5/c12-5-1-7(9(14)15-3-5)10-17-8-2-6(13)4-16-11(8)18-10/h1-4H,(H2,14,15)(H,16,17,18)
InChIKeySERGCCVLLRWNTL-UHFFFAOYSA-N
XLogP3.02
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.57
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine (CID 122196555) is 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine is Nc1ncc(Br)cc1-c1nc2ncc(Cl)cc2[nH]1.
What is the InChIKey of 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
The InChIKey is SERGCCVLLRWNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrClN5/c12-5-1-7(9(14)15-3-5)10-17-8-2-6(13)4-16-11(8)18-10/h1-4H,(H2,14,15)(H,16,17,18).
What are the key properties of 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine has a molecular weight of 324.57 g/mol, XLogP of 3.02, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine is sourced from PubChem (CID 122196555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).