5-methylimidazo[1,2-a]quinoline-9-carbaldehyde

C13H10N2O — CID 115026845

IUPAC5-methylimidazo[1,2-a]quinoline-9-carbaldehyde
SMILESCc1cc2nccn2c2c(C=O)cccc12
InChIInChI=1S/C13H10N2O/c1-9-7-12-14-5-6-15(12)13-10(8-16)3-2-4-11(9)13/h2-8H,1H3
InChIKeyARXXSMCYSWVUDE-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.61
Rot. Bonds1

About 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde

5-methylimidazo[1,2-a]quinoline-9-carbaldehyde (PubChem CID 115026845) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde.

Molecular Properties

Compound Name5-methylimidazo[1,2-a]quinoline-9-carbaldehyde
PubChem CID115026845
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name5-methylimidazo[1,2-a]quinoline-9-carbaldehyde
SMILESCc1cc2nccn2c2c(C=O)cccc12
InChIInChI=1S/C13H10N2O/c1-9-7-12-14-5-6-15(12)13-10(8-16)3-2-4-11(9)13/h2-8H,1H3
InChIKeyARXXSMCYSWVUDE-UHFFFAOYSA-N
XLogP2.61
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde 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 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde?
The IUPAC name of 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde (CID 115026845) is 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde.
What is the SMILES notation for 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde?
The canonical SMILES for 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde is Cc1cc2nccn2c2c(C=O)cccc12.
What is the InChIKey of 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde?
The InChIKey is ARXXSMCYSWVUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c1-9-7-12-14-5-6-15(12)13-10(8-16)3-2-4-11(9)13/h2-8H,1H3.
What are the key properties of 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde?
5-methylimidazo[1,2-a]quinoline-9-carbaldehyde has a molecular weight of 210.24 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylimidazo[1,2-a]quinoline-9-carbaldehyde is sourced from PubChem (CID 115026845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).