8-hydroxyquinoline-5-carbaldehyde;hydrochloride

C10H8ClNO2 — CID 71444137

IUPAC8-hydroxyquinoline-5-carbaldehyde;hydrochloride
SMILESCl.O=Cc1ccc(O)c2ncccc12
InChIInChI=1S/C10H7NO2.ClH/c12-6-7-3-4-9(13)10-8(7)2-1-5-11-10;/h1-6,13H;1H
InChIKeyZJONKYPLPDYTCQ-UHFFFAOYSA-N
MW209.63 g/mol
LogP2.17
Rot. Bonds1

About 8-hydroxyquinoline-5-carbaldehyde;hydrochloride

8-hydroxyquinoline-5-carbaldehyde;hydrochloride (PubChem CID 71444137) has the molecular formula C10H8ClNO2 and a molecular weight of 209.63 g/mol. Its IUPAC name is 8-hydroxyquinoline-5-carbaldehyde;hydrochloride.

Molecular Properties

Compound Name8-hydroxyquinoline-5-carbaldehyde;hydrochloride
PubChem CID71444137
Molecular FormulaC10H8ClNO2
Molecular Weight209.63 g/mol
Exact Mass209.02
IUPAC Name8-hydroxyquinoline-5-carbaldehyde;hydrochloride
SMILESCl.O=Cc1ccc(O)c2ncccc12
InChIInChI=1S/C10H7NO2.ClH/c12-6-7-3-4-9(13)10-8(7)2-1-5-11-10;/h1-6,13H;1H
InChIKeyZJONKYPLPDYTCQ-UHFFFAOYSA-N
XLogP2.17
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.63
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 8-hydroxyquinoline-5-carbaldehyde;hydrochloride 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 8-hydroxyquinoline-5-carbaldehyde;hydrochloride?
The IUPAC name of 8-hydroxyquinoline-5-carbaldehyde;hydrochloride (CID 71444137) is 8-hydroxyquinoline-5-carbaldehyde;hydrochloride.
What is the SMILES notation for 8-hydroxyquinoline-5-carbaldehyde;hydrochloride?
The canonical SMILES for 8-hydroxyquinoline-5-carbaldehyde;hydrochloride is Cl.O=Cc1ccc(O)c2ncccc12.
What is the InChIKey of 8-hydroxyquinoline-5-carbaldehyde;hydrochloride?
The InChIKey is ZJONKYPLPDYTCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO2.ClH/c12-6-7-3-4-9(13)10-8(7)2-1-5-11-10;/h1-6,13H;1H.
What are the key properties of 8-hydroxyquinoline-5-carbaldehyde;hydrochloride?
8-hydroxyquinoline-5-carbaldehyde;hydrochloride has a molecular weight of 209.63 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxyquinoline-5-carbaldehyde;hydrochloride is sourced from PubChem (CID 71444137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).