N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide

C8H15N3O2 — CID 6018224

IUPACN'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide
SMILESN/C(CC(=O)N1CCCCC1)=N/O
InChIInChI=1S/C8H15N3O2/c9-7(10-13)6-8(12)11-4-2-1-3-5-11/h13H,1-6H2,(H2,9,10)
InChIKeyCGYVBSAXNLNUHU-UHFFFAOYSA-N
MW185.23 g/mol
LogP0.14
Rot. Bonds2

About N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide

N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide (PubChem CID 6018224) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide.

Molecular Properties

Compound NameN'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide
PubChem CID6018224
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC NameN'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide
SMILESN/C(CC(=O)N1CCCCC1)=N/O
InChIInChI=1S/C8H15N3O2/c9-7(10-13)6-8(12)11-4-2-1-3-5-11/h13H,1-6H2,(H2,9,10)
InChIKeyCGYVBSAXNLNUHU-UHFFFAOYSA-N
XLogP0.14
TPSA78.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 50.14
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'}

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Related Compounds

N'-hydroxy-3-oxo-3-[3-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 65531805
N'-hydroxy-1-(3,3,3-trifluoropropanoyl)piperidine-3-carboximidamide
CID 77041541
N'-hydroxy-3-oxo-3-[3-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 77073192
N'-hydroxy-3-oxo-3-[4-(trifluoromethyl)piperidin-1-yl]propanimidamide
CID 77073208
1-acetyl-N'-hydroxypiperidine-4-carboximidamide
CID 73852023
CID 124488260
CID 124488260
N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide
CID 4134339
3-Oxo-3-piperidin-1-ylpropanimidamide
CID 4367605
N'-hydroxy-3-oxo-3-(piperidin-1-yl)propanimidamide
CID 16771881
3-(4-ethylpiperazin-1-yl)-N'-hydroxy-3-oxopropanimidamide
CID 16772098
4-Piperidinecarboximidamide, 1-acetyl-N-hydroxy-
CID 21882816
3-(4-Hydroxyiminopiperidin-1-yl)propanamide
CID 43152557

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide?
The IUPAC name of N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide (CID 6018224) is N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide.
What is the SMILES notation for N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide?
The canonical SMILES for N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide is N/C(CC(=O)N1CCCCC1)=N/O.
What is the InChIKey of N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide?
The InChIKey is CGYVBSAXNLNUHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c9-7(10-13)6-8(12)11-4-2-1-3-5-11/h13H,1-6H2,(H2,9,10).
What are the key properties of N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide?
N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide has a molecular weight of 185.23 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-3-oxo-3-piperidin-1-ylpropanimidamide is sourced from PubChem (CID 6018224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).