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

C11H12N2O — CID 135949929

IUPAC4-ethyl-2-(1H-pyrazol-5-yl)phenol
SMILESCCc1ccc(O)c(-c2ccn[nH]2)c1
InChIInChI=1S/C11H12N2O/c1-2-8-3-4-11(14)9(7-8)10-5-6-12-13-10/h3-7,14H,2H2,1H3,(H,12,13)
InChIKeyTZMRUQWCXUZYKL-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.34
Rot. Bonds2

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

4-ethyl-2-(1H-pyrazol-5-yl)phenol (PubChem CID 135949929) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 4-ethyl-2-(1H-pyrazol-5-yl)phenol.

Molecular Properties

Compound Name4-ethyl-2-(1H-pyrazol-5-yl)phenol
PubChem CID135949929
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name4-ethyl-2-(1H-pyrazol-5-yl)phenol
SMILESCCc1ccc(O)c(-c2ccn[nH]2)c1
InChIInChI=1S/C11H12N2O/c1-2-8-3-4-11(14)9(7-8)10-5-6-12-13-10/h3-7,14H,2H2,1H3,(H,12,13)
InChIKeyTZMRUQWCXUZYKL-UHFFFAOYSA-N
XLogP2.34
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-hydroxy-1H-indazole
CID 135483987
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o-(1H-pyrazol-3-yl)phenol
CID 819511
Vrt-532
CID 781239
4-Fluoro-2-(1H-pyrazol-3-yl)phenol
CID 5068606
2-[5-(2-Fluorophenyl)-1H-pyrazol-3-yl]phenol
CID 136226476
4-Bromo-2-(1H-pyrazol-3-yl)phenol
CID 838844
2-[5-(1,1,2,2-tetrafluoroethyl)-1H-pyrazol-3-yl]phenol
CID 762936
2-(5-(4-fluorophenyl)-1H-pyrazol-3-yl)phenol
CID 759784
2-[5-(4-tert-Butyl-phenyl)-1H-pyrazol-3-yl]-phenol
CID 775984
5-Methyl-2-(5-p-tolyl-1H-pyrazol-3-yl)-phenol
CID 775990
4-(4-methoxyphenyl)-3-methyl-1H-pyrazole
CID 2805464

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(1H-pyrazol-5-yl)phenol?
The IUPAC name of 4-ethyl-2-(1H-pyrazol-5-yl)phenol (CID 135949929) is 4-ethyl-2-(1H-pyrazol-5-yl)phenol.
What is the SMILES notation for 4-ethyl-2-(1H-pyrazol-5-yl)phenol?
The canonical SMILES for 4-ethyl-2-(1H-pyrazol-5-yl)phenol is CCc1ccc(O)c(-c2ccn[nH]2)c1.
What is the InChIKey of 4-ethyl-2-(1H-pyrazol-5-yl)phenol?
The InChIKey is TZMRUQWCXUZYKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-2-8-3-4-11(14)9(7-8)10-5-6-12-13-10/h3-7,14H,2H2,1H3,(H,12,13).
What are the key properties of 4-ethyl-2-(1H-pyrazol-5-yl)phenol?
4-ethyl-2-(1H-pyrazol-5-yl)phenol has a molecular weight of 188.23 g/mol, XLogP of 2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(1H-pyrazol-5-yl)phenol is sourced from PubChem (CID 135949929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).