4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine

C17H19N7O3 — CID 25023721

IUPAC4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
SMILESCCn1c(-c2nonc2N)nc2c(-c3ccoc3)ncc(OCCCN)c21
InChIInChI=1S/C17H19N7O3/c1-2-24-15-11(26-6-3-5-18)8-20-12(10-4-7-25-9-10)13(15)21-17(24)14-16(19)23-27-22-14/h4,7-9H,2-3,5-6,18H2,1H3,(H2,19,23)
InChIKeySXRCGQAHDJRHJC-UHFFFAOYSA-N
MW369.39 g/mol
LogP2.07
Rot. Bonds7

About 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine

4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine (PubChem CID 25023721) has the molecular formula C17H19N7O3 and a molecular weight of 369.39 g/mol. Its IUPAC name is 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine.

Molecular Properties

Compound Name4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
PubChem CID25023721
Molecular FormulaC17H19N7O3
Molecular Weight369.39 g/mol
Exact Mass369.15
IUPAC Name4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
SMILESCCn1c(-c2nonc2N)nc2c(-c3ccoc3)ncc(OCCCN)c21
InChIInChI=1S/C17H19N7O3/c1-2-24-15-11(26-6-3-5-18)8-20-12(10-4-7-25-9-10)13(15)21-17(24)14-16(19)23-27-22-14/h4,7-9H,2-3,5-6,18H2,1H3,(H2,19,23)
InChIKeySXRCGQAHDJRHJC-UHFFFAOYSA-N
XLogP2.07
TPSA144.04 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.39
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Related Compounds

N-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)-4-(morpholin-4-yl)benzamide
CID 16099846
N-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)-4-[2-(dimethylamino)ethoxy]benzamide
CID 16099848
N-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)-4-(aminomethyl)benzamide
CID 16099860
N-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 16099861
4-[7-(3-aminopropoxy)-1-ethyl-4-phenyl-1H-imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
CID 11245934
N-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)benzamide
CID 11339681
1-(3-{[2-(4-Amino-furazan-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)ethanone
CID 11772907
N-(3-((2-(4-Amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl)oxy)phenyl)-4-(dimethylamino)benzamide
CID 16099859
6-Furan-2-yl-9-phenethyl-9H-purin-2-ylamine
CID 44401799
9-benzyl-6-(furan-2-yl)-9H-purin-2-amine
CID 44401938
4-[7-(3-aminopropoxy)-1-ethyl-4-(1H-pyrrol-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine
CID 25023722
4-[2-(4-amino-1,2,5-oxadiazol-3-yl)-7-[(3S)-3-amino-4-phenylbutoxy]-1-ethyl-1H-imidazo[4,5-c]pyridin-4-yl]-2-methylbut-3-yn-2-ol
CID 25023732

Frequently Asked Questions

What is the IUPAC name of 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine?
The IUPAC name of 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine (CID 25023721) is 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine.
What is the SMILES notation for 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine?
The canonical SMILES for 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine is CCn1c(-c2nonc2N)nc2c(-c3ccoc3)ncc(OCCCN)c21.
What is the InChIKey of 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine?
The InChIKey is SXRCGQAHDJRHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7O3/c1-2-24-15-11(26-6-3-5-18)8-20-12(10-4-7-25-9-10)13(15)21-17(24)14-16(19)23-27-22-14/h4,7-9H,2-3,5-6,18H2,1H3,(H2,19,23).
What are the key properties of 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine?
4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine has a molecular weight of 369.39 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-(3-aminopropoxy)-1-ethyl-4-(furan-3-yl)imidazo[4,5-c]pyridin-2-yl]-1,2,5-oxadiazol-3-amine is sourced from PubChem (CID 25023721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).