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

C7H10N2O — CID 54593563

IUPAC4,5,6,7-tetrahydro-1H-indazol-7-ol
SMILESOC1CCCc2cn[nH]c21
InChIInChI=1S/C7H10N2O/c10-6-3-1-2-5-4-8-9-7(5)6/h4,6,10H,1-3H2,(H,8,9)
InChIKeyVQMSYECVUXBUOI-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.78
Rot. Bonds

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

4,5,6,7-tetrahydro-1H-indazol-7-ol (PubChem CID 54593563) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-1H-indazol-7-ol.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-1H-indazol-7-ol
PubChem CID54593563
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name4,5,6,7-tetrahydro-1H-indazol-7-ol
SMILESOC1CCCc2cn[nH]c21
InChIInChI=1S/C7H10N2O/c10-6-3-1-2-5-4-8-9-7(5)6/h4,6,10H,1-3H2,(H,8,9)
InChIKeyVQMSYECVUXBUOI-UHFFFAOYSA-N
XLogP0.78
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydro-1H-indazol-7-ol?
The IUPAC name of 4,5,6,7-tetrahydro-1H-indazol-7-ol (CID 54593563) is 4,5,6,7-tetrahydro-1H-indazol-7-ol.
What is the SMILES notation for 4,5,6,7-tetrahydro-1H-indazol-7-ol?
The canonical SMILES for 4,5,6,7-tetrahydro-1H-indazol-7-ol is OC1CCCc2cn[nH]c21.
What is the InChIKey of 4,5,6,7-tetrahydro-1H-indazol-7-ol?
The InChIKey is VQMSYECVUXBUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c10-6-3-1-2-5-4-8-9-7(5)6/h4,6,10H,1-3H2,(H,8,9).
What are the key properties of 4,5,6,7-tetrahydro-1H-indazol-7-ol?
4,5,6,7-tetrahydro-1H-indazol-7-ol has a molecular weight of 138.17 g/mol, XLogP of 0.78, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-1H-indazol-7-ol is sourced from PubChem (CID 54593563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).