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

C10H16N2O — CID 129296491

IUPAC6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol
SMILESCC(C)C1CCc2cn[nH]c2C1O
InChIInChI=1S/C10H16N2O/c1-6(2)8-4-3-7-5-11-12-9(7)10(8)13/h5-6,8,10,13H,3-4H2,1-2H3,(H,11,12)
InChIKeyHVGLYAOBDHTHDN-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.66
Rot. Bonds1

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

6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol (PubChem CID 129296491) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol.

Molecular Properties

Compound Name6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol
PubChem CID129296491
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol
SMILESCC(C)C1CCc2cn[nH]c2C1O
InChIInChI=1S/C10H16N2O/c1-6(2)8-4-3-7-5-11-12-9(7)10(8)13/h5-6,8,10,13H,3-4H2,1-2H3,(H,11,12)
InChIKeyHVGLYAOBDHTHDN-UHFFFAOYSA-N
XLogP1.66
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
The IUPAC name of 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol (CID 129296491) is 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol.
What is the SMILES notation for 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
The canonical SMILES for 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol is CC(C)C1CCc2cn[nH]c2C1O.
What is the InChIKey of 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
The InChIKey is HVGLYAOBDHTHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-6(2)8-4-3-7-5-11-12-9(7)10(8)13/h5-6,8,10,13H,3-4H2,1-2H3,(H,11,12).
What are the key properties of 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol has a molecular weight of 180.25 g/mol, XLogP of 1.66, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol is sourced from PubChem (CID 129296491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).