N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide

C11H17N3O4 — CID 136867043

IUPACN'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
SMILESCOCCOCCOc1cccc(/C(N)=N/O)n1
InChIInChI=1S/C11H17N3O4/c1-16-5-6-17-7-8-18-10-4-2-3-9(13-10)11(12)14-15/h2-4,15H,5-8H2,1H3,(H2,12,14)
InChIKeyXPLYFRBXHZRAIA-UHFFFAOYSA-N
MW255.27 g/mol
LogP0.22
Rot. Bonds8

About N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide

N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide (PubChem CID 136867043) has the molecular formula C11H17N3O4 and a molecular weight of 255.27 g/mol. Its IUPAC name is N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
PubChem CID136867043
Molecular FormulaC11H17N3O4
Molecular Weight255.27 g/mol
Exact Mass255.12
IUPAC NameN'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
SMILESCOCCOCCOc1cccc(/C(N)=N/O)n1
InChIInChI=1S/C11H17N3O4/c1-16-5-6-17-7-8-18-10-4-2-3-9(13-10)11(12)14-15/h2-4,15H,5-8H2,1H3,(H2,12,14)
InChIKeyXPLYFRBXHZRAIA-UHFFFAOYSA-N
XLogP0.22
TPSA99.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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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Related Compounds

6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-2-carboximidamide
CID 104562293
N'-hydroxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carboximidamide
CID 104562144
N'-hydroxy-5-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
CID 136867042
[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]methanol
CID 104564147
2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine
CID 104561399
N'-hydroxy-4-[2-(2-methoxyethoxy)ethoxy]benzenecarboximidamide
CID 61301378
N'-(1,3-dimethoxypropan-2-yl)-6-methoxypyridine-2-carboximidamide
CID 139548383
N-ethyl-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridin-2-amine
CID 104568139
N-[4-[[amino(phenyl)methylidene]amino]-2-methyl-4-oxobutan-2-yl]-6-(2-methoxyethoxy)pyridine-2-carboxamide
CID 144936513
N'-hydroxy-2-[2-(2-methoxyethoxy)ethoxy]-4-methylpyridine-3-carboximidamide
CID 104562166
6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpyridin-3-amine
CID 104559873
4-[2-(2-methoxyethoxy)ethoxy]pyrimidin-2-amine
CID 104568278

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide?
The IUPAC name of N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide (CID 136867043) is N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide.
What is the SMILES notation for N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide?
The canonical SMILES for N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide is COCCOCCOc1cccc(/C(N)=N/O)n1.
What is the InChIKey of N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide?
The InChIKey is XPLYFRBXHZRAIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4/c1-16-5-6-17-7-8-18-10-4-2-3-9(13-10)11(12)14-15/h2-4,15H,5-8H2,1H3,(H2,12,14).
What are the key properties of N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide?
N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide has a molecular weight of 255.27 g/mol, XLogP of 0.22, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-6-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide is sourced from PubChem (CID 136867043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).