N'-hydroxyquinoline-6-carboximidamide

C10H9N3O — CID 59214181

IUPACN'-hydroxyquinoline-6-carboximidamide
SMILESN/C(=N\O)c1ccc2ncccc2c1
InChIInChI=1S/C10H9N3O/c11-10(13-14)8-3-4-9-7(6-8)2-1-5-12-9/h1-6,14H,(H2,11,13)
InChIKeyMLCHRNMXZYCJGE-UHFFFAOYSA-N
MW187.20 g/mol
LogP1.33
Rot. Bonds1

About N'-hydroxyquinoline-6-carboximidamide

N'-hydroxyquinoline-6-carboximidamide (PubChem CID 59214181) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is N'-hydroxyquinoline-6-carboximidamide.

Molecular Properties

Compound NameN'-hydroxyquinoline-6-carboximidamide
PubChem CID59214181
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC NameN'-hydroxyquinoline-6-carboximidamide
SMILESN/C(=N\O)c1ccc2ncccc2c1
InChIInChI=1S/C10H9N3O/c11-10(13-14)8-3-4-9-7(6-8)2-1-5-12-9/h1-6,14H,(H2,11,13)
InChIKeyMLCHRNMXZYCJGE-UHFFFAOYSA-N
XLogP1.33
TPSA71.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'}

Analyze N'-hydroxyquinoline-6-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-hydroxyquinoline-6-carboximidamide?
The IUPAC name of N'-hydroxyquinoline-6-carboximidamide (CID 59214181) is N'-hydroxyquinoline-6-carboximidamide.
What is the SMILES notation for N'-hydroxyquinoline-6-carboximidamide?
The canonical SMILES for N'-hydroxyquinoline-6-carboximidamide is N/C(=N\O)c1ccc2ncccc2c1.
What is the InChIKey of N'-hydroxyquinoline-6-carboximidamide?
The InChIKey is MLCHRNMXZYCJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c11-10(13-14)8-3-4-9-7(6-8)2-1-5-12-9/h1-6,14H,(H2,11,13).
What are the key properties of N'-hydroxyquinoline-6-carboximidamide?
N'-hydroxyquinoline-6-carboximidamide has a molecular weight of 187.20 g/mol, XLogP of 1.33, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxyquinoline-6-carboximidamide is sourced from PubChem (CID 59214181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).