6-methoxy-2,5-dimethylindazole

C10H12N2O — CID 162433035

IUPAC6-methoxy-2,5-dimethylindazole
SMILESCOc1cc2nn(C)cc2cc1C
InChIInChI=1S/C10H12N2O/c1-7-4-8-6-12(2)11-9(8)5-10(7)13-3/h4-6H,1-3H3
InChIKeyVKPAPXYSKNDYPI-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.89
Rot. Bonds1

About 6-methoxy-2,5-dimethylindazole

6-methoxy-2,5-dimethylindazole (PubChem CID 162433035) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 6-methoxy-2,5-dimethylindazole.

Molecular Properties

Compound Name6-methoxy-2,5-dimethylindazole
PubChem CID162433035
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name6-methoxy-2,5-dimethylindazole
SMILESCOc1cc2nn(C)cc2cc1C
InChIInChI=1S/C10H12N2O/c1-7-4-8-6-12(2)11-9(8)5-10(7)13-3/h4-6H,1-3H3
InChIKeyVKPAPXYSKNDYPI-UHFFFAOYSA-N
XLogP1.89
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-2,5-dimethylindazole 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 6-methoxy-2,5-dimethylindazole?
The IUPAC name of 6-methoxy-2,5-dimethylindazole (CID 162433035) is 6-methoxy-2,5-dimethylindazole.
What is the SMILES notation for 6-methoxy-2,5-dimethylindazole?
The canonical SMILES for 6-methoxy-2,5-dimethylindazole is COc1cc2nn(C)cc2cc1C.
What is the InChIKey of 6-methoxy-2,5-dimethylindazole?
The InChIKey is VKPAPXYSKNDYPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-7-4-8-6-12(2)11-9(8)5-10(7)13-3/h4-6H,1-3H3.
What are the key properties of 6-methoxy-2,5-dimethylindazole?
6-methoxy-2,5-dimethylindazole has a molecular weight of 176.22 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,5-dimethylindazole is sourced from PubChem (CID 162433035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).