4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline

C13H13N3O2 — CID 46232590

IUPAC4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline
SMILESCOc1ccc2nc3n[nH]c(C)c3c(OC)c2c1
InChIInChI=1S/C13H13N3O2/c1-7-11-12(18-3)9-6-8(17-2)4-5-10(9)14-13(11)16-15-7/h4-6H,1-3H3,(H,14,15,16)
InChIKeyAWSLSQGTMWLKRH-UHFFFAOYSA-N
MW243.27 g/mol
LogP2.44
Rot. Bonds2

About 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline

4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline (PubChem CID 46232590) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline.

Molecular Properties

Compound Name4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline
PubChem CID46232590
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline
SMILESCOc1ccc2nc3n[nH]c(C)c3c(OC)c2c1
InChIInChI=1S/C13H13N3O2/c1-7-11-12(18-3)9-6-8(17-2)4-5-10(9)14-13(11)16-15-7/h4-6H,1-3H3,(H,14,15,16)
InChIKeyAWSLSQGTMWLKRH-UHFFFAOYSA-N
XLogP2.44
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline 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 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline?
The IUPAC name of 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline (CID 46232590) is 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline.
What is the SMILES notation for 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline?
The canonical SMILES for 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline is COc1ccc2nc3n[nH]c(C)c3c(OC)c2c1.
What is the InChIKey of 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline?
The InChIKey is AWSLSQGTMWLKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-7-11-12(18-3)9-6-8(17-2)4-5-10(9)14-13(11)16-15-7/h4-6H,1-3H3,(H,14,15,16).
What are the key properties of 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline?
4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline has a molecular weight of 243.27 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-3-methyl-2H-pyrazolo[3,4-b]quinoline is sourced from PubChem (CID 46232590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).