5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide

C10H13N3O2 — CID 136990877

IUPAC5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide
SMILESN/C(=N/O)c1ccc(OC2CCC2)cn1
InChIInChI=1S/C10H13N3O2/c11-10(13-14)9-5-4-8(6-12-9)15-7-2-1-3-7/h4-7,14H,1-3H2,(H2,11,13)
InChIKeyMCILKUCFUAXLGM-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.11
Rot. Bonds3

About 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide

5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide (PubChem CID 136990877) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide.

Molecular Properties

Compound Name5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide
PubChem CID136990877
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide
SMILESN/C(=N/O)c1ccc(OC2CCC2)cn1
InChIInChI=1S/C10H13N3O2/c11-10(13-14)9-5-4-8(6-12-9)15-7-2-1-3-7/h4-7,14H,1-3H2,(H2,11,13)
InChIKeyMCILKUCFUAXLGM-UHFFFAOYSA-N
XLogP1.11
TPSA80.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.11
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

N'-hydroxy-5-(oxan-4-yloxy)pyridine-2-carboximidamide
CID 136990868
N'-hydroxy-5-(1-methylpiperidin-4-yl)oxypyridine-2-carboximidamide
CID 136990869
N'-hydroxy-5-(2-methylcyclohexyl)oxypyridine-2-carboximidamide
CID 136967342
N'-hydroxy-5-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridine-2-carboximidamide
CID 136990779
N'-hydroxy-5-methoxypyridine-2-carboximidamide
CID 135743705
5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136731200
5-cycloheptyloxypyridine-2-carboxylic acid
CID 115491140
N'-hydroxy-5-(oxan-4-ylmethoxy)pyridine-2-carboximidamide
CID 136967354
5-[cyclopentyl(methyl)amino]-N'-hydroxypyridine-2-carboximidamide
CID 136967271
N'-hydroxy-5-pyridin-3-yloxypyridine-2-carboximidamide
CID 136990827
N'-hydroxy-5-(2-phenoxyethoxy)pyridine-2-carboximidamide
CID 136990781
N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide
CID 136990863

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide?
The IUPAC name of 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide (CID 136990877) is 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide.
What is the SMILES notation for 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide?
The canonical SMILES for 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide is N/C(=N/O)c1ccc(OC2CCC2)cn1.
What is the InChIKey of 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide?
The InChIKey is MCILKUCFUAXLGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c11-10(13-14)9-5-4-8(6-12-9)15-7-2-1-3-7/h4-7,14H,1-3H2,(H2,11,13).
What are the key properties of 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide?
5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide has a molecular weight of 207.23 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide is sourced from PubChem (CID 136990877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).