5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide

C11H15N3O2 — CID 136731200

IUPAC5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
SMILESN/C(=N/O)c1ccc(OCCC2CC2)cn1
InChIInChI=1S/C11H15N3O2/c12-11(14-15)10-4-3-9(7-13-10)16-6-5-8-1-2-8/h3-4,7-8,15H,1-2,5-6H2,(H2,12,14)
InChIKeyJNVVKXXBLOKLHU-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.36
Rot. Bonds5

About 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide

5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide (PubChem CID 136731200) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide.

Molecular Properties

Compound Name5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
PubChem CID136731200
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
SMILESN/C(=N/O)c1ccc(OCCC2CC2)cn1
InChIInChI=1S/C11H15N3O2/c12-11(14-15)10-4-3-9(7-13-10)16-6-5-8-1-2-8/h3-4,7-8,15H,1-2,5-6H2,(H2,12,14)
InChIKeyJNVVKXXBLOKLHU-UHFFFAOYSA-N
XLogP1.36
TPSA80.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.36
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-(2-phenoxyethoxy)pyridine-2-carboximidamide
CID 136990781
N'-hydroxy-5-(oxan-4-ylmethoxy)pyridine-2-carboximidamide
CID 136967354
N'-hydroxy-5-methoxypyridine-2-carboximidamide
CID 135743705
5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide
CID 136990877
N'-hydroxy-5-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
CID 136867042
N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide
CID 136990863
1-[5-(2-cyclobutylethoxy)-2-pyridinyl]ethanone
CID 106202175
N'-hydroxy-5-(oxan-4-yloxy)pyridine-2-carboximidamide
CID 136990868
5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde
CID 79794927
N'-hydroxy-5-(2-methylcyclohexyl)oxypyridine-2-carboximidamide
CID 136967342
N'-hydroxy-5-(1-methylpiperidin-4-yl)oxypyridine-2-carboximidamide
CID 136990869
N-[1-[4-(2-cyclopropylethoxy)phenyl]ethylidene]hydroxylamine
CID 77073927

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide?
The IUPAC name of 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide (CID 136731200) is 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide.
What is the SMILES notation for 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide?
The canonical SMILES for 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide is N/C(=N/O)c1ccc(OCCC2CC2)cn1.
What is the InChIKey of 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide?
The InChIKey is JNVVKXXBLOKLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c12-11(14-15)10-4-3-9(7-13-10)16-6-5-8-1-2-8/h3-4,7-8,15H,1-2,5-6H2,(H2,12,14).
What are the key properties of 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide?
5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide has a molecular weight of 221.26 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide is sourced from PubChem (CID 136731200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).