1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol

C11H14N4O2 — CID 102660706

IUPAC1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESCCc1nnc(C)cc1-c1nc(C(C)O)no1
InChIInChI=1S/C11H14N4O2/c1-4-9-8(5-6(2)13-14-9)11-12-10(7(3)16)15-17-11/h5,7,16H,4H2,1-3H3
InChIKeyWGBNNDMFGGDWFD-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.45
Rot. Bonds3

About 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol

1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol (PubChem CID 102660706) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol.

Molecular Properties

Compound Name1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol
PubChem CID102660706
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESCCc1nnc(C)cc1-c1nc(C(C)O)no1
InChIInChI=1S/C11H14N4O2/c1-4-9-8(5-6(2)13-14-9)11-12-10(7(3)16)15-17-11/h5,7,16H,4H2,1-3H3
InChIKeyWGBNNDMFGGDWFD-UHFFFAOYSA-N
XLogP1.45
TPSA84.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol 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 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol?
The IUPAC name of 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol (CID 102660706) is 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol.
What is the SMILES notation for 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol?
The canonical SMILES for 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol is CCc1nnc(C)cc1-c1nc(C(C)O)no1.
What is the InChIKey of 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol?
The InChIKey is WGBNNDMFGGDWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-4-9-8(5-6(2)13-14-9)11-12-10(7(3)16)15-17-11/h5,7,16H,4H2,1-3H3.
What are the key properties of 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol?
1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol has a molecular weight of 234.26 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]ethanol is sourced from PubChem (CID 102660706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).