2-(3,5-dimethylpyrazol-1-yl)phenol

C11H12N2O — CID 761553

IUPAC2-(3,5-dimethylpyrazol-1-yl)phenol
SMILESCc1cc(C)n(-c2ccccc2O)n1
InChIInChI=1S/C11H12N2O/c1-8-7-9(2)13(12-8)10-5-3-4-6-11(10)14/h3-7,14H,1-2H3
InChIKeyUFLNGSAFJHIAQR-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.19
Rot. Bonds1

About 2-(3,5-dimethylpyrazol-1-yl)phenol

2-(3,5-dimethylpyrazol-1-yl)phenol (PubChem CID 761553) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)phenol.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)phenol
PubChem CID761553
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)phenol
SMILESCc1cc(C)n(-c2ccccc2O)n1
InChIInChI=1S/C11H12N2O/c1-8-7-9(2)13(12-8)10-5-3-4-6-11(10)14/h3-7,14H,1-2H3
InChIKeyUFLNGSAFJHIAQR-UHFFFAOYSA-N
XLogP2.19
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

carbonic acid;2-(3,5-dimethylpyrazol-1-yl)phenol
CID 118510416
[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanol
CID 12746736
bis[2-(3,5-dimethylpyrazol-1-yl)phenyl]diazene
CID 12718144
1-(2-ethylphenyl)-3,5-dimethylpyrazole
CID 39240354
3,5-dimethyl-1-(2-propan-2-ylphenyl)pyrazole
CID 82078471
2-(3,5-dimethylpyrazol-1-yl)benzenecarbothioamide
CID 28602187
2-amino-1-[2-(3,5-dimethylpyrazol-1-yl)phenyl]ethanol
CID 83823935
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide
CID 52847994
2-(3,5-dimethylpyrazol-1-yl)pyridin-3-ol
CID 122205736
1-[2-(furan-2-yl)phenyl]-3,5-dimethylpyrazole
CID 168525628
1-(5-bromo-2-methylphenyl)-3,5-dimethylpyrazole
CID 130121149
3-(3,5-dimethylpyrazol-1-yl)-1H-indole
CID 3573300

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)phenol?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)phenol (CID 761553) is 2-(3,5-dimethylpyrazol-1-yl)phenol.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)phenol?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)phenol is Cc1cc(C)n(-c2ccccc2O)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)phenol?
The InChIKey is UFLNGSAFJHIAQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-8-7-9(2)13(12-8)10-5-3-4-6-11(10)14/h3-7,14H,1-2H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)phenol?
2-(3,5-dimethylpyrazol-1-yl)phenol has a molecular weight of 188.23 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)phenol is sourced from PubChem (CID 761553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).