2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol

C10H17N3O — CID 112711209

IUPAC2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol
SMILESCNCc1c2c(nn1C)CCCC2O
InChIInChI=1S/C10H17N3O/c1-11-6-8-10-7(12-13(8)2)4-3-5-9(10)14/h9,11,14H,3-6H2,1-2H3
InChIKeyVZGUXHCLZKPXKR-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.51
Rot. Bonds2

About 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol

2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol (PubChem CID 112711209) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol.

Molecular Properties

Compound Name2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol
PubChem CID112711209
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol
SMILESCNCc1c2c(nn1C)CCCC2O
InChIInChI=1S/C10H17N3O/c1-11-6-8-10-7(12-13(8)2)4-3-5-9(10)14/h9,11,14H,3-6H2,1-2H3
InChIKeyVZGUXHCLZKPXKR-UHFFFAOYSA-N
XLogP0.51
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-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 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol?
The IUPAC name of 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol (CID 112711209) is 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol.
What is the SMILES notation for 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol?
The canonical SMILES for 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol is CNCc1c2c(nn1C)CCCC2O.
What is the InChIKey of 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol?
The InChIKey is VZGUXHCLZKPXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-11-6-8-10-7(12-13(8)2)4-3-5-9(10)14/h9,11,14H,3-6H2,1-2H3.
What are the key properties of 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol?
2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol has a molecular weight of 195.27 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylaminomethyl)-4,5,6,7-tetrahydroindazol-4-ol is sourced from PubChem (CID 112711209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).