5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole

C10H16N2 — CID 59550085

IUPAC5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
SMILESCC(C)C1CCc2[nH]ncc2C1
InChIInChI=1S/C10H16N2/c1-7(2)8-3-4-10-9(5-8)6-11-12-10/h6-8H,3-5H2,1-2H3,(H,11,12)
InChIKeyJECUVWLLGKRWRV-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.17
Rot. Bonds1

About 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole

5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole (PubChem CID 59550085) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole.

Molecular Properties

Compound Name5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
PubChem CID59550085
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
SMILESCC(C)C1CCc2[nH]ncc2C1
InChIInChI=1S/C10H16N2/c1-7(2)8-3-4-10-9(5-8)6-11-12-10/h6-8H,3-5H2,1-2H3,(H,11,12)
InChIKeyJECUVWLLGKRWRV-UHFFFAOYSA-N
XLogP2.17
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole 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 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
The IUPAC name of 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole (CID 59550085) is 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole.
What is the SMILES notation for 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
The canonical SMILES for 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole is CC(C)C1CCc2[nH]ncc2C1.
What is the InChIKey of 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
The InChIKey is JECUVWLLGKRWRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-7(2)8-3-4-10-9(5-8)6-11-12-10/h6-8H,3-5H2,1-2H3,(H,11,12).
What are the key properties of 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole?
5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole has a molecular weight of 164.25 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole is sourced from PubChem (CID 59550085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).