2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine

C12H11BrN6 — CID 70695756

IUPAC2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine
SMILESCNc1c(Br)cnc2nc(-c3ccnc(N)c3)[nH]c12
InChIInChI=1S/C12H11BrN6/c1-15-9-7(13)5-17-12-10(9)18-11(19-12)6-2-3-16-8(14)4-6/h2-5H,1H3,(H2,14,16)(H2,15,17,18,19)
InChIKeyYOUNKSLLTJRACV-UHFFFAOYSA-N
MW319.17 g/mol
LogP2.41
Rot. Bonds2

About 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine

2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine (PubChem CID 70695756) has the molecular formula C12H11BrN6 and a molecular weight of 319.17 g/mol. Its IUPAC name is 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine
PubChem CID70695756
Molecular FormulaC12H11BrN6
Molecular Weight319.17 g/mol
Exact Mass318.02
IUPAC Name2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine
SMILESCNc1c(Br)cnc2nc(-c3ccnc(N)c3)[nH]c12
InChIInChI=1S/C12H11BrN6/c1-15-9-7(13)5-17-12-10(9)18-11(19-12)6-2-3-16-8(14)4-6/h2-5H,1H3,(H2,14,16)(H2,15,17,18,19)
InChIKeyYOUNKSLLTJRACV-UHFFFAOYSA-N
XLogP2.41
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.17
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine?
The IUPAC name of 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine (CID 70695756) is 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine?
The canonical SMILES for 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine is CNc1c(Br)cnc2nc(-c3ccnc(N)c3)[nH]c12.
What is the InChIKey of 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine?
The InChIKey is YOUNKSLLTJRACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN6/c1-15-9-7(13)5-17-12-10(9)18-11(19-12)6-2-3-16-8(14)4-6/h2-5H,1H3,(H2,14,16)(H2,15,17,18,19).
What are the key properties of 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine?
2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine has a molecular weight of 319.17 g/mol, XLogP of 2.41, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 70695756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).