5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine

C13H20N4O — CID 65482865

IUPAC5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine
SMILESCOc1ccc2[nH]c(CCC(C)CCN)nc2n1
InChIInChI=1S/C13H20N4O/c1-9(7-8-14)3-5-11-15-10-4-6-12(18-2)17-13(10)16-11/h4,6,9H,3,5,7-8,14H2,1-2H3,(H,15,16,17)
InChIKeyJOEAHAODMLDIQE-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.88
Rot. Bonds6

About 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine

5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine (PubChem CID 65482865) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine.

Molecular Properties

Compound Name5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine
PubChem CID65482865
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine
SMILESCOc1ccc2[nH]c(CCC(C)CCN)nc2n1
InChIInChI=1S/C13H20N4O/c1-9(7-8-14)3-5-11-15-10-4-6-12(18-2)17-13(10)16-11/h4,6,9H,3,5,7-8,14H2,1-2H3,(H,15,16,17)
InChIKeyJOEAHAODMLDIQE-UHFFFAOYSA-N
XLogP1.88
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine?
The IUPAC name of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine (CID 65482865) is 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine.
What is the SMILES notation for 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine?
The canonical SMILES for 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine is COc1ccc2[nH]c(CCC(C)CCN)nc2n1.
What is the InChIKey of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine?
The InChIKey is JOEAHAODMLDIQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-9(7-8-14)3-5-11-15-10-4-6-12(18-2)17-13(10)16-11/h4,6,9H,3,5,7-8,14H2,1-2H3,(H,15,16,17).
What are the key properties of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine?
5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine has a molecular weight of 248.33 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylpentan-1-amine is sourced from PubChem (CID 65482865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).