3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one

C10H10N2O2 — CID 105444082

IUPAC3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one
SMILESCn1[nH]c(=O)cc1-c1ccccc1O
InChIInChI=1S/C10H10N2O2/c1-12-8(6-10(14)11-12)7-4-2-3-5-9(7)13/h2-6,13H,1H3,(H,11,14)
InChIKeyMXLLNLGUZAREDD-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.09
Rot. Bonds1

About 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one

3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one (PubChem CID 105444082) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one
PubChem CID105444082
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one
SMILESCn1[nH]c(=O)cc1-c1ccccc1O
InChIInChI=1S/C10H10N2O2/c1-12-8(6-10(14)11-12)7-4-2-3-5-9(7)13/h2-6,13H,1H3,(H,11,14)
InChIKeyMXLLNLGUZAREDD-UHFFFAOYSA-N
XLogP1.09
TPSA58.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one 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 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one?
The IUPAC name of 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one (CID 105444082) is 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one.
What is the SMILES notation for 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one?
The canonical SMILES for 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one is Cn1[nH]c(=O)cc1-c1ccccc1O.
What is the InChIKey of 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one?
The InChIKey is MXLLNLGUZAREDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-12-8(6-10(14)11-12)7-4-2-3-5-9(7)13/h2-6,13H,1H3,(H,11,14).
What are the key properties of 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one?
3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one has a molecular weight of 190.20 g/mol, XLogP of 1.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyphenyl)-2-methyl-1H-pyrazol-5-one is sourced from PubChem (CID 105444082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).