2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine

C11H16N4O — CID 79821222

IUPAC2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCCOCCc1nc2nc(N)ccc2[nH]1
InChIInChI=1S/C11H16N4O/c1-2-6-16-7-5-10-13-8-3-4-9(12)14-11(8)15-10/h3-4H,2,5-7H2,1H3,(H3,12,13,14,15)
InChIKeyKOLHYBFPRLSLOR-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.51
Rot. Bonds5

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

2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821222) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821222
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCCOCCc1nc2nc(N)ccc2[nH]1
InChIInChI=1S/C11H16N4O/c1-2-6-16-7-5-10-13-8-3-4-9(12)14-11(8)15-10/h3-4H,2,5-7H2,1H3,(H3,12,13,14,15)
InChIKeyKOLHYBFPRLSLOR-UHFFFAOYSA-N
XLogP1.51
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821394
2-(methoxymethyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821303
2-[2-(aminomethyl)butyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 81072327
2-[3-(2-aminoethyl)hexyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821623
2-(5-aminopentyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79820779
2-(methylsulfonylmethyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821236
2-[3-(propan-2-ylamino)propyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821367
2-[(4-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821064
6-bromo-2-(2-propoxyethyl)-1H-benzimidazole
CID 64723125
7-methyl-2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridine
CID 63722820
2-[(1-aminocyclopentyl)methyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821707
2-[(2-aminophenyl)methyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821282

Frequently Asked Questions

What is the IUPAC name of 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821222) is 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine is CCCOCCc1nc2nc(N)ccc2[nH]1.
What is the InChIKey of 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is KOLHYBFPRLSLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-2-6-16-7-5-10-13-8-3-4-9(12)14-11(8)15-10/h3-4H,2,5-7H2,1H3,(H3,12,13,14,15).
What are the key properties of 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 220.28 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).