1-(4-hydroxyphenyl)pyrazol-4-ol

C9H8N2O2 — CID 117124802

IUPAC1-(4-hydroxyphenyl)pyrazol-4-ol
SMILESOc1ccc(-n2cc(O)cn2)cc1
InChIInChI=1S/C9H8N2O2/c12-8-3-1-7(2-4-8)11-6-9(13)5-10-11/h1-6,12-13H
InChIKeyUISGQAIHEBZCFI-UHFFFAOYSA-N
MW176.17 g/mol
LogP1.28
Rot. Bonds1

About 1-(4-hydroxyphenyl)pyrazol-4-ol

1-(4-hydroxyphenyl)pyrazol-4-ol (PubChem CID 117124802) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)pyrazol-4-ol.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)pyrazol-4-ol
PubChem CID117124802
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name1-(4-hydroxyphenyl)pyrazol-4-ol
SMILESOc1ccc(-n2cc(O)cn2)cc1
InChIInChI=1S/C9H8N2O2/c12-8-3-1-7(2-4-8)11-6-9(13)5-10-11/h1-6,12-13H
InChIKeyUISGQAIHEBZCFI-UHFFFAOYSA-N
XLogP1.28
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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4-[4-(2-aminoethyl)pyrazol-1-yl]phenol
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4-[4-(difluoromethoxy)pyrazol-1-yl]phenol
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4-[[4-(4-methylpyrazol-1-yl)phenyl]diazenyl]phenol
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4-(4-ethoxypyrazol-1-yl)phenol
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4-(4-cyclopentyloxypyrazol-1-yl)phenol
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4-(1-phenylpyrazol-4-yl)oxyphenol
CID 117229486
CID 158795306
CID 158795306
4-bromo-1-(4-bromophenyl)pyrazole
CID 15940041
1-pyrazin-2-ylpyrazol-4-ol
CID 122241026

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)pyrazol-4-ol?
The IUPAC name of 1-(4-hydroxyphenyl)pyrazol-4-ol (CID 117124802) is 1-(4-hydroxyphenyl)pyrazol-4-ol.
What is the SMILES notation for 1-(4-hydroxyphenyl)pyrazol-4-ol?
The canonical SMILES for 1-(4-hydroxyphenyl)pyrazol-4-ol is Oc1ccc(-n2cc(O)cn2)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)pyrazol-4-ol?
The InChIKey is UISGQAIHEBZCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c12-8-3-1-7(2-4-8)11-6-9(13)5-10-11/h1-6,12-13H.
What are the key properties of 1-(4-hydroxyphenyl)pyrazol-4-ol?
1-(4-hydroxyphenyl)pyrazol-4-ol has a molecular weight of 176.17 g/mol, XLogP of 1.28, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)pyrazol-4-ol is sourced from PubChem (CID 117124802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).