2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide

C11H17N7O3 — CID 66205412

IUPAC2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCOCCNCc1cn(CC(=O)Nc2nnc(C)o2)nn1
InChIInChI=1S/C11H17N7O3/c1-8-14-16-11(21-8)13-10(19)7-18-6-9(15-17-18)5-12-3-4-20-2/h6,12H,3-5,7H2,1-2H3,(H,13,16,19)
InChIKeyGFLLFDRXCMJJMJ-UHFFFAOYSA-N
MW295.30 g/mol
LogP-0.66
Rot. Bonds8

About 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide

2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 66205412) has the molecular formula C11H17N7O3 and a molecular weight of 295.30 g/mol. Its IUPAC name is 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID66205412
Molecular FormulaC11H17N7O3
Molecular Weight295.30 g/mol
Exact Mass295.14
IUPAC Name2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCOCCNCc1cn(CC(=O)Nc2nnc(C)o2)nn1
InChIInChI=1S/C11H17N7O3/c1-8-14-16-11(21-8)13-10(19)7-18-6-9(15-17-18)5-12-3-4-20-2/h6,12H,3-5,7H2,1-2H3,(H,13,16,19)
InChIKeyGFLLFDRXCMJJMJ-UHFFFAOYSA-N
XLogP-0.66
TPSA119.99 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide 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 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide (CID 66205412) is 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide is COCCNCc1cn(CC(=O)Nc2nnc(C)o2)nn1.
What is the InChIKey of 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is GFLLFDRXCMJJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7O3/c1-8-14-16-11(21-8)13-10(19)7-18-6-9(15-17-18)5-12-3-4-20-2/h6,12H,3-5,7H2,1-2H3,(H,13,16,19).
What are the key properties of 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 295.30 g/mol, XLogP of -0.66, 8 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 66205412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).