6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol

C9H14N2O — CID 129296585

IUPAC6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
SMILESCCC1CCc2cn[nH]c2C1O
InChIInChI=1S/C9H14N2O/c1-2-6-3-4-7-5-10-11-8(7)9(6)12/h5-6,9,12H,2-4H2,1H3,(H,10,11)
InChIKeyJHYUOXYOPDHLSE-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.42
Rot. Bonds1

About 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol

6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol (PubChem CID 129296585) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol.

Molecular Properties

Compound Name6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
PubChem CID129296585
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
SMILESCCC1CCc2cn[nH]c2C1O
InChIInChI=1S/C9H14N2O/c1-2-6-3-4-7-5-10-11-8(7)9(6)12/h5-6,9,12H,2-4H2,1H3,(H,10,11)
InChIKeyJHYUOXYOPDHLSE-UHFFFAOYSA-N
XLogP1.42
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
The IUPAC name of 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol (CID 129296585) is 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol.
What is the SMILES notation for 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
The canonical SMILES for 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol is CCC1CCc2cn[nH]c2C1O.
What is the InChIKey of 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
The InChIKey is JHYUOXYOPDHLSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-2-6-3-4-7-5-10-11-8(7)9(6)12/h5-6,9,12H,2-4H2,1H3,(H,10,11).
What are the key properties of 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol?
6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol has a molecular weight of 166.22 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol is sourced from PubChem (CID 129296585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).