4-ethoxy-N'-hydroxy-5-methoxypentanimidamide

C8H18N2O3 — CID 58478330

IUPAC4-ethoxy-N'-hydroxy-5-methoxypentanimidamide
SMILESCCOC(CC/C(N)=N\O)COC
InChIInChI=1S/C8H18N2O3/c1-3-13-7(6-12-2)4-5-8(9)10-11/h7,11H,3-6H2,1-2H3,(H2,9,10)
InChIKeyBMEUNOLYGPBQNN-UHFFFAOYSA-N
MW190.24 g/mol
LogP0.56
Rot. Bonds7

About 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide

4-ethoxy-N'-hydroxy-5-methoxypentanimidamide (PubChem CID 58478330) has the molecular formula C8H18N2O3 and a molecular weight of 190.24 g/mol. Its IUPAC name is 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide.

Molecular Properties

Compound Name4-ethoxy-N'-hydroxy-5-methoxypentanimidamide
PubChem CID58478330
Molecular FormulaC8H18N2O3
Molecular Weight190.24 g/mol
Exact Mass190.13
IUPAC Name4-ethoxy-N'-hydroxy-5-methoxypentanimidamide
SMILESCCOC(CC/C(N)=N\O)COC
InChIInChI=1S/C8H18N2O3/c1-3-13-7(6-12-2)4-5-8(9)10-11/h7,11H,3-6H2,1-2H3,(H2,9,10)
InChIKeyBMEUNOLYGPBQNN-UHFFFAOYSA-N
XLogP0.56
TPSA77.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide 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-ethoxy-N'-hydroxy-5-methoxypentanimidamide?
The IUPAC name of 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide (CID 58478330) is 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide.
What is the SMILES notation for 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide?
The canonical SMILES for 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide is CCOC(CC/C(N)=N\O)COC.
What is the InChIKey of 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide?
The InChIKey is BMEUNOLYGPBQNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3/c1-3-13-7(6-12-2)4-5-8(9)10-11/h7,11H,3-6H2,1-2H3,(H2,9,10).
What are the key properties of 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide?
4-ethoxy-N'-hydroxy-5-methoxypentanimidamide has a molecular weight of 190.24 g/mol, XLogP of 0.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N'-hydroxy-5-methoxypentanimidamide is sourced from PubChem (CID 58478330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).