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

C11H14N4O — CID 79821401

IUPAC2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESNc1ccc2[nH]c(C3CCCOC3)nc2n1
InChIInChI=1S/C11H14N4O/c12-9-4-3-8-11(14-9)15-10(13-8)7-2-1-5-16-6-7/h3-4,7H,1-2,5-6H2,(H3,12,13,14,15)
InChIKeyLIEKNXFBVCBOMN-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.43
Rot. Bonds1

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

2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821401) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821401
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESNc1ccc2[nH]c(C3CCCOC3)nc2n1
InChIInChI=1S/C11H14N4O/c12-9-4-3-8-11(14-9)15-10(13-8)7-2-1-5-16-6-7/h3-4,7H,1-2,5-6H2,(H3,12,13,14,15)
InChIKeyLIEKNXFBVCBOMN-UHFFFAOYSA-N
XLogP1.43
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridine
CID 65484248
5-methyl-2-(oxolan-3-yl)-1H-imidazo[4,5-b]pyridine
CID 81136991
2-amino-6-(oxan-3-yl)-1H-1,3,5-triazine-4-thione
CID 83241537
2-(2-adamantyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 81098853
6-bromo-2-[(3R)-oxan-3-yl]-1H-benzimidazole
CID 70141450
[2-(oxan-3-yl)-1H-benzimidazol-4-yl]methanamine
CID 104721251
2-(oxan-3-yl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazole
CID 55151063
2-(3-methylpyrrolidin-2-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 102776738
2-cyclobutyl-5-methyl-1H-imidazo[4,5-b]pyridine
CID 81137891
2-(2,3-dihydro-1-benzofuran-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79820809
2-(5-amino-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexane-1-carboxylic acid
CID 79820848
2-(2,3-dihydro-1H-indol-2-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821353

Frequently Asked Questions

What is the IUPAC name of 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821401) is 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine is Nc1ccc2[nH]c(C3CCCOC3)nc2n1.
What is the InChIKey of 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is LIEKNXFBVCBOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c12-9-4-3-8-11(14-9)15-10(13-8)7-2-1-5-16-6-7/h3-4,7H,1-2,5-6H2,(H3,12,13,14,15).
What are the key properties of 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine?
2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 218.26 g/mol, XLogP of 1.43, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).