1,4-dimethylindazol-7-ol

C9H10N2O — CID 105431858

IUPAC1,4-dimethylindazol-7-ol
SMILESCc1ccc(O)c2c1cnn2C
InChIInChI=1S/C9H10N2O/c1-6-3-4-8(12)9-7(6)5-10-11(9)2/h3-5,12H,1-2H3
InChIKeyVRJBAMWHWJSKGK-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.59
Rot. Bonds

About 1,4-dimethylindazol-7-ol

1,4-dimethylindazol-7-ol (PubChem CID 105431858) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 1,4-dimethylindazol-7-ol.

Molecular Properties

Compound Name1,4-dimethylindazol-7-ol
PubChem CID105431858
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name1,4-dimethylindazol-7-ol
SMILESCc1ccc(O)c2c1cnn2C
InChIInChI=1S/C9H10N2O/c1-6-3-4-8(12)9-7(6)5-10-11(9)2/h3-5,12H,1-2H3
InChIKeyVRJBAMWHWJSKGK-UHFFFAOYSA-N
XLogP1.59
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylindazol-7-ol?
The IUPAC name of 1,4-dimethylindazol-7-ol (CID 105431858) is 1,4-dimethylindazol-7-ol.
What is the SMILES notation for 1,4-dimethylindazol-7-ol?
The canonical SMILES for 1,4-dimethylindazol-7-ol is Cc1ccc(O)c2c1cnn2C.
What is the InChIKey of 1,4-dimethylindazol-7-ol?
The InChIKey is VRJBAMWHWJSKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-6-3-4-8(12)9-7(6)5-10-11(9)2/h3-5,12H,1-2H3.
What are the key properties of 1,4-dimethylindazol-7-ol?
1,4-dimethylindazol-7-ol has a molecular weight of 162.19 g/mol, XLogP of 1.59, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylindazol-7-ol is sourced from PubChem (CID 105431858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).