2-(5-methyl-1H-pyrazol-3-yl)phenol

C10H10N2O — CID 135604546

IUPAC2-(5-methyl-1H-pyrazol-3-yl)phenol
SMILESCc1cc(-c2ccccc2O)n[nH]1
InChIInChI=1S/C10H10N2O/c1-7-6-9(12-11-7)8-4-2-3-5-10(8)13/h2-6,13H,1H3,(H,11,12)
InChIKeyJCMDGLURXBBIQX-UHFFFAOYSA-N
MW174.20 g/mol
LogP2.09
Rot. Bonds1

About 2-(5-methyl-1H-pyrazol-3-yl)phenol

2-(5-methyl-1H-pyrazol-3-yl)phenol (PubChem CID 135604546) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-(5-methyl-1H-pyrazol-3-yl)phenol.

Molecular Properties

Compound Name2-(5-methyl-1H-pyrazol-3-yl)phenol
PubChem CID135604546
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name2-(5-methyl-1H-pyrazol-3-yl)phenol
SMILESCc1cc(-c2ccccc2O)n[nH]1
InChIInChI=1S/C10H10N2O/c1-7-6-9(12-11-7)8-4-2-3-5-10(8)13/h2-6,13H,1H3,(H,11,12)
InChIKeyJCMDGLURXBBIQX-UHFFFAOYSA-N
XLogP2.09
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)phenol?
The IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)phenol (CID 135604546) is 2-(5-methyl-1H-pyrazol-3-yl)phenol.
What is the SMILES notation for 2-(5-methyl-1H-pyrazol-3-yl)phenol?
The canonical SMILES for 2-(5-methyl-1H-pyrazol-3-yl)phenol is Cc1cc(-c2ccccc2O)n[nH]1.
What is the InChIKey of 2-(5-methyl-1H-pyrazol-3-yl)phenol?
The InChIKey is JCMDGLURXBBIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-6-9(12-11-7)8-4-2-3-5-10(8)13/h2-6,13H,1H3,(H,11,12).
What are the key properties of 2-(5-methyl-1H-pyrazol-3-yl)phenol?
2-(5-methyl-1H-pyrazol-3-yl)phenol has a molecular weight of 174.20 g/mol, XLogP of 2.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-pyrazol-3-yl)phenol is sourced from PubChem (CID 135604546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).