N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide

C8H17N3O3 — CID 58057767

IUPACN'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide
SMILESCOCOC1CCN(/C(N)=N/O)CC1
InChIInChI=1S/C8H17N3O3/c1-13-6-14-7-2-4-11(5-3-7)8(9)10-12/h7,12H,2-6H2,1H3,(H2,9,10)
InChIKeyOTDUTBSUVHWYGQ-UHFFFAOYSA-N
MW203.24 g/mol
LogP-0.22
Rot. Bonds3

About N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide

N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide (PubChem CID 58057767) has the molecular formula C8H17N3O3 and a molecular weight of 203.24 g/mol. Its IUPAC name is N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide
PubChem CID58057767
Molecular FormulaC8H17N3O3
Molecular Weight203.24 g/mol
Exact Mass203.13
IUPAC NameN'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide
SMILESCOCOC1CCN(/C(N)=N/O)CC1
InChIInChI=1S/C8H17N3O3/c1-13-6-14-7-2-4-11(5-3-7)8(9)10-12/h7,12H,2-6H2,1H3,(H2,9,10)
InChIKeyOTDUTBSUVHWYGQ-UHFFFAOYSA-N
XLogP-0.22
TPSA80.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'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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Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide?
The IUPAC name of N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide (CID 58057767) is N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide.
What is the SMILES notation for N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide?
The canonical SMILES for N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide is COCOC1CCN(/C(N)=N/O)CC1.
What is the InChIKey of N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide?
The InChIKey is OTDUTBSUVHWYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3/c1-13-6-14-7-2-4-11(5-3-7)8(9)10-12/h7,12H,2-6H2,1H3,(H2,9,10).
What are the key properties of N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide?
N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide has a molecular weight of 203.24 g/mol, XLogP of -0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-4-(methoxymethoxy)piperidine-1-carboximidamide is sourced from PubChem (CID 58057767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).