3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide

C12H23N3O2 — CID 55158926

IUPAC3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide
SMILESCCC1(C)CCN(C(=O)C(C)/C(N)=N/O)CC1
InChIInChI=1S/C12H23N3O2/c1-4-12(3)5-7-15(8-6-12)11(16)9(2)10(13)14-17/h9,17H,4-8H2,1-3H3,(H2,13,14)
InChIKeyGWYHYWSPELBZCJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.41
Rot. Bonds3

About 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide

3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide (PubChem CID 55158926) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide.

Molecular Properties

Compound Name3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide
PubChem CID55158926
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide
SMILESCCC1(C)CCN(C(=O)C(C)/C(N)=N/O)CC1
InChIInChI=1S/C12H23N3O2/c1-4-12(3)5-7-15(8-6-12)11(16)9(2)10(13)14-17/h9,17H,4-8H2,1-3H3,(H2,13,14)
InChIKeyGWYHYWSPELBZCJ-UHFFFAOYSA-N
XLogP1.41
TPSA78.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.41
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 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide 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

N'-hydroxy-2-methyl-3-oxo-3-[3-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 65531807
N'-hydroxy-2-methyl-3-oxo-3-[4-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 65532774
2-ethyl-N'-hydroxy-2-[3-(trifluoromethyl)piperidine-1-carbonyl]butanimidamide
CID 77073184
N'-hydroxy-2-[3-(trifluoromethyl)piperidine-1-carbonyl]butanimidamide
CID 77073189
N'-hydroxy-2-[3-(trifluoromethyl)piperidine-1-carbonyl]pentanimidamide
CID 77073190
N'-hydroxy-3-methyl-2-[3-(trifluoromethyl)piperidine-1-carbonyl]butanimidamide
CID 77073191
N'-hydroxy-2-methyl-3-oxo-3-[3-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 77073193
N'-hydroxy-2,2-dimethyl-3-oxo-3-[3-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 77073197
2-ethyl-N'-hydroxy-2-[4-(trifluoromethyl)piperidine-1-carbonyl]butanimidamide
CID 77073203
N'-hydroxy-2-[4-(trifluoromethyl)piperidine-1-carbonyl]butanimidamide
CID 77073204
N'-hydroxy-2-[4-(trifluoromethyl)piperidine-1-carbonyl]pentanimidamide
CID 77073205
N'-hydroxy-3-methyl-2-[4-(trifluoromethyl)piperidine-1-carbonyl]butanimidamide
CID 77073206

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide?
The IUPAC name of 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide (CID 55158926) is 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide.
What is the SMILES notation for 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide?
The canonical SMILES for 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide is CCC1(C)CCN(C(=O)C(C)/C(N)=N/O)CC1.
What is the InChIKey of 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide?
The InChIKey is GWYHYWSPELBZCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-12(3)5-7-15(8-6-12)11(16)9(2)10(13)14-17/h9,17H,4-8H2,1-3H3,(H2,13,14).
What are the key properties of 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide?
3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide has a molecular weight of 241.33 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethyl-4-methylpiperidin-1-yl)-N'-hydroxy-2-methyl-3-oxopropanimidamide is sourced from PubChem (CID 55158926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).