N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide

C9H9N5O — CID 24693678

IUPACN'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide
SMILESN/C(=N\O)c1cccnc1-n1cccn1
InChIInChI=1S/C9H9N5O/c10-8(13-15)7-3-1-4-11-9(7)14-6-2-5-12-14/h1-6,15H,(H2,10,13)
InChIKeyXOENPDZHHMWQKX-UHFFFAOYSA-N
MW203.21 g/mol
LogP0.36
Rot. Bonds2

About N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide

N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide (PubChem CID 24693678) has the molecular formula C9H9N5O and a molecular weight of 203.21 g/mol. Its IUPAC name is N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide
PubChem CID24693678
Molecular FormulaC9H9N5O
Molecular Weight203.21 g/mol
Exact Mass203.08
IUPAC NameN'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide
SMILESN/C(=N\O)c1cccnc1-n1cccn1
InChIInChI=1S/C9H9N5O/c10-8(13-15)7-3-1-4-11-9(7)14-6-2-5-12-14/h1-6,15H,(H2,10,13)
InChIKeyXOENPDZHHMWQKX-UHFFFAOYSA-N
XLogP0.36
TPSA89.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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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Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide?
The IUPAC name of N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide (CID 24693678) is N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide.
What is the SMILES notation for N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide?
The canonical SMILES for N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide is N/C(=N\O)c1cccnc1-n1cccn1.
What is the InChIKey of N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide?
The InChIKey is XOENPDZHHMWQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O/c10-8(13-15)7-3-1-4-11-9(7)14-6-2-5-12-14/h1-6,15H,(H2,10,13).
What are the key properties of N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide?
N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide has a molecular weight of 203.21 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-pyrazol-1-ylpyridine-3-carboximidamide is sourced from PubChem (CID 24693678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).