3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol

C8H12N2O — CID 13333938

IUPAC3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol
SMILESCc1[nH]nc2c1C(O)CCC2
InChIInChI=1S/C8H12N2O/c1-5-8-6(10-9-5)3-2-4-7(8)11/h7,11H,2-4H2,1H3,(H,9,10)
InChIKeyYEWYCQJTJKGTEY-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.09
Rot. Bonds

About 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol

3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol (PubChem CID 13333938) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol.

Molecular Properties

Compound Name3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol
PubChem CID13333938
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol
SMILESCc1[nH]nc2c1C(O)CCC2
InChIInChI=1S/C8H12N2O/c1-5-8-6(10-9-5)3-2-4-7(8)11/h7,11H,2-4H2,1H3,(H,9,10)
InChIKeyYEWYCQJTJKGTEY-UHFFFAOYSA-N
XLogP1.09
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol 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 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol?
The IUPAC name of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol (CID 13333938) is 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol.
What is the SMILES notation for 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol?
The canonical SMILES for 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol is Cc1[nH]nc2c1C(O)CCC2.
What is the InChIKey of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol?
The InChIKey is YEWYCQJTJKGTEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-5-8-6(10-9-5)3-2-4-7(8)11/h7,11H,2-4H2,1H3,(H,9,10).
What are the key properties of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol?
3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol has a molecular weight of 152.20 g/mol, XLogP of 1.09, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,5,6,7-tetrahydro-2H-indazol-4-ol is sourced from PubChem (CID 13333938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).