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

C10H10N2O — CID 2759320

IUPAC4-methyl-2-(1H-pyrazol-5-yl)phenol
SMILESCc1ccc(O)c(-c2ccn[nH]2)c1
InChIInChI=1S/C10H10N2O/c1-7-2-3-10(13)8(6-7)9-4-5-11-12-9/h2-6,13H,1H3,(H,11,12)
InChIKeyKFOTULBCYDISHU-UHFFFAOYSA-N
MW174.20 g/mol
LogP2.09
Rot. Bonds1

About 4-methyl-2-(1H-pyrazol-5-yl)phenol

4-methyl-2-(1H-pyrazol-5-yl)phenol (PubChem CID 2759320) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 4-methyl-2-(1H-pyrazol-5-yl)phenol.

Molecular Properties

Compound Name4-methyl-2-(1H-pyrazol-5-yl)phenol
PubChem CID2759320
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name4-methyl-2-(1H-pyrazol-5-yl)phenol
SMILESCc1ccc(O)c(-c2ccn[nH]2)c1
InChIInChI=1S/C10H10N2O/c1-7-2-3-10(13)8(6-7)9-4-5-11-12-9/h2-6,13H,1H3,(H,11,12)
InChIKeyKFOTULBCYDISHU-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 4-methyl-2-(1H-pyrazol-5-yl)phenol?
The IUPAC name of 4-methyl-2-(1H-pyrazol-5-yl)phenol (CID 2759320) is 4-methyl-2-(1H-pyrazol-5-yl)phenol.
What is the SMILES notation for 4-methyl-2-(1H-pyrazol-5-yl)phenol?
The canonical SMILES for 4-methyl-2-(1H-pyrazol-5-yl)phenol is Cc1ccc(O)c(-c2ccn[nH]2)c1.
What is the InChIKey of 4-methyl-2-(1H-pyrazol-5-yl)phenol?
The InChIKey is KFOTULBCYDISHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-2-3-10(13)8(6-7)9-4-5-11-12-9/h2-6,13H,1H3,(H,11,12).
What are the key properties of 4-methyl-2-(1H-pyrazol-5-yl)phenol?
4-methyl-2-(1H-pyrazol-5-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 4-methyl-2-(1H-pyrazol-5-yl)phenol is sourced from PubChem (CID 2759320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).