4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide

C10H16N6O3 — CID 7657873

IUPAC4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide
SMILESN/C(=N\OCC(=O)N1CCCCC1)c1nonc1N
InChIInChI=1S/C10H16N6O3/c11-9(8-10(12)15-19-13-8)14-18-6-7(17)16-4-2-1-3-5-16/h1-6H2,(H2,11,14)(H2,12,15)
InChIKeyGDPMCWAXJYALJC-UHFFFAOYSA-N
MW268.28 g/mol
LogP-0.70
Rot. Bonds4

About 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide

4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide (PubChem CID 7657873) has the molecular formula C10H16N6O3 and a molecular weight of 268.28 g/mol. Its IUPAC name is 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide.

Molecular Properties

Compound Name4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide
PubChem CID7657873
Molecular FormulaC10H16N6O3
Molecular Weight268.28 g/mol
Exact Mass268.13
IUPAC Name4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide
SMILESN/C(=N\OCC(=O)N1CCCCC1)c1nonc1N
InChIInChI=1S/C10H16N6O3/c11-9(8-10(12)15-19-13-8)14-18-6-7(17)16-4-2-1-3-5-16/h1-6H2,(H2,11,14)(H2,12,15)
InChIKeyGDPMCWAXJYALJC-UHFFFAOYSA-N
XLogP-0.70
TPSA132.86 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide 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 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide?
The IUPAC name of 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide (CID 7657873) is 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide.
What is the SMILES notation for 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide?
The canonical SMILES for 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide is N/C(=N\OCC(=O)N1CCCCC1)c1nonc1N.
What is the InChIKey of 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide?
The InChIKey is GDPMCWAXJYALJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O3/c11-9(8-10(12)15-19-13-8)14-18-6-7(17)16-4-2-1-3-5-16/h1-6H2,(H2,11,14)(H2,12,15).
What are the key properties of 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide?
4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide has a molecular weight of 268.28 g/mol, XLogP of -0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N'-(2-oxo-2-piperidin-1-ylethoxy)-1,2,5-oxadiazole-3-carboximidamide is sourced from PubChem (CID 7657873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).