N'-hydroxy-5-methoxypyridine-2-carboximidamide

C7H9N3O2 — CID 135743705

IUPACN'-hydroxy-5-methoxypyridine-2-carboximidamide
SMILESCOc1ccc(/C(N)=N/O)nc1
InChIInChI=1S/C7H9N3O2/c1-12-5-2-3-6(9-4-5)7(8)10-11/h2-4,11H,1H3,(H2,8,10)
InChIKeyORAOLRMCSKVOSJ-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.18
Rot. Bonds2

About N'-hydroxy-5-methoxypyridine-2-carboximidamide

N'-hydroxy-5-methoxypyridine-2-carboximidamide (PubChem CID 135743705) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is N'-hydroxy-5-methoxypyridine-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-5-methoxypyridine-2-carboximidamide
PubChem CID135743705
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC NameN'-hydroxy-5-methoxypyridine-2-carboximidamide
SMILESCOc1ccc(/C(N)=N/O)nc1
InChIInChI=1S/C7H9N3O2/c1-12-5-2-3-6(9-4-5)7(8)10-11/h2-4,11H,1H3,(H2,8,10)
InChIKeyORAOLRMCSKVOSJ-UHFFFAOYSA-N
XLogP0.18
TPSA80.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

5-(3,5-dimethoxyphenoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136990840
N',5-dimethoxypyridine-2-carboximidamide
CID 123379844
N'-hydroxy-5-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
CID 136867042
N'-hydroxy-5-(2-phenoxyethoxy)pyridine-2-carboximidamide
CID 136990781
5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide
CID 136990877
N'-hydroxy-5-pyridin-3-yloxypyridine-2-carboximidamide
CID 136990827
5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136731200
ethyl 2-[[6-(N'-hydroxycarbamimidoyl)-3-pyridinyl]oxy]butanoate
CID 137154260
5-methoxy-N'-piperidin-4-ylpyridine-2-carboximidamide
CID 144934608
N'-hydroxy-5-[(2-methyl-3-pyridinyl)oxy]pyridine-2-carboximidamide
CID 136967358
N'-hydroxy-5-(2-methylcyclohexyl)oxypyridine-2-carboximidamide
CID 136967342
N'-hydroxy-5-[2-(3-methoxyphenyl)ethylamino]pyridine-2-carboximidamide
CID 177365516

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-5-methoxypyridine-2-carboximidamide?
The IUPAC name of N'-hydroxy-5-methoxypyridine-2-carboximidamide (CID 135743705) is N'-hydroxy-5-methoxypyridine-2-carboximidamide.
What is the SMILES notation for N'-hydroxy-5-methoxypyridine-2-carboximidamide?
The canonical SMILES for N'-hydroxy-5-methoxypyridine-2-carboximidamide is COc1ccc(/C(N)=N/O)nc1.
What is the InChIKey of N'-hydroxy-5-methoxypyridine-2-carboximidamide?
The InChIKey is ORAOLRMCSKVOSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-12-5-2-3-6(9-4-5)7(8)10-11/h2-4,11H,1H3,(H2,8,10).
What are the key properties of N'-hydroxy-5-methoxypyridine-2-carboximidamide?
N'-hydroxy-5-methoxypyridine-2-carboximidamide has a molecular weight of 167.17 g/mol, XLogP of 0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5-methoxypyridine-2-carboximidamide is sourced from PubChem (CID 135743705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).