N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide

C7H16N2O2 — CID 43128403

IUPACN'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide
SMILESCCC(C)(C)OC/C(N)=N/O
InChIInChI=1S/C7H16N2O2/c1-4-7(2,3)11-5-6(8)9-10/h10H,4-5H2,1-3H3,(H2,8,9)
InChIKeyOSCIKPWONJYNST-UHFFFAOYSA-N
MW160.22 g/mol
LogP0.94
Rot. Bonds4

About N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide

N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide (PubChem CID 43128403) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide.

Molecular Properties

Compound NameN'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide
PubChem CID43128403
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC NameN'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide
SMILESCCC(C)(C)OC/C(N)=N/O
InChIInChI=1S/C7H16N2O2/c1-4-7(2,3)11-5-6(8)9-10/h10H,4-5H2,1-3H3,(H2,8,9)
InChIKeyOSCIKPWONJYNST-UHFFFAOYSA-N
XLogP0.94
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethoxy-N'-hydroxyethanimidamide
CID 10582776
3,3,3-trifluoro-N'-hydroxy-2-(2-methylbutan-2-yloxymethyl)propanimidamide
CID 103370388
N'-hydroxy-2-(3-methoxy-3-methylbutoxy)ethanimidamide
CID 106665827
N'-hydroxy-3-[(2-methylpropan-2-yl)oxy]propanimidamide
CID 74859890
2-methylbutan-2-yl 2-(2-methylbutan-2-yloxy)acetate
CID 140993287
2-butan-2-yloxy-N'-hydroxyethanimidamide
CID 76883223
N'-hydroxy-4-[(2-methylpropan-2-yl)oxy]butanimidamide
CID 43128381
(2-amino-2-hydroxyiminoethyl) dihydrogen phosphate
CID 71402250
3-fluoro-N'-hydroxy-4-(2-methylbutan-2-yloxymethyl)benzenecarboximidamide
CID 43128405
N'-hydroxy-4-(3-methylpentan-3-ylamino)butanimidamide
CID 106329372
N'-hydroxy-3-[methyl(2-methylbutan-2-yl)amino]propanimidamide
CID 77014154
2-(4-ethoxyphenoxy)-N'-hydroxyethanimidamide
CID 24695727

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide?
The IUPAC name of N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide (CID 43128403) is N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide.
What is the SMILES notation for N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide?
The canonical SMILES for N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide is CCC(C)(C)OC/C(N)=N/O.
What is the InChIKey of N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide?
The InChIKey is OSCIKPWONJYNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-4-7(2,3)11-5-6(8)9-10/h10H,4-5H2,1-3H3,(H2,8,9).
What are the key properties of N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide?
N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide has a molecular weight of 160.22 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-(2-methylbutan-2-yloxy)ethanimidamide is sourced from PubChem (CID 43128403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).