2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol

C15H11FN2O — CID 759784

IUPAC2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol
SMILESOc1ccccc1-c1cc(-c2ccc(F)cc2)n[nH]1
InChIInChI=1S/C15H11FN2O/c16-11-7-5-10(6-8-11)13-9-14(18-17-13)12-3-1-2-4-15(12)19/h1-9,19H,(H,17,18)
InChIKeyPCCNBBWUCGTENW-UHFFFAOYSA-N
MW254.26 g/mol
LogP3.59
Rot. Bonds2

About 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol

2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol (PubChem CID 759784) has the molecular formula C15H11FN2O and a molecular weight of 254.26 g/mol. Its IUPAC name is 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol.

Molecular Properties

Compound Name2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol
PubChem CID759784
Molecular FormulaC15H11FN2O
Molecular Weight254.26 g/mol
Exact Mass254.09
IUPAC Name2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol
SMILESOc1ccccc1-c1cc(-c2ccc(F)cc2)n[nH]1
InChIInChI=1S/C15H11FN2O/c16-11-7-5-10(6-8-11)13-9-14(18-17-13)12-3-1-2-4-15(12)19/h1-9,19H,(H,17,18)
InChIKeyPCCNBBWUCGTENW-UHFFFAOYSA-N
XLogP3.59
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

o-(1H-pyrazol-3-yl)phenol
CID 819511
Vrt-532
CID 781239
4-Fluoro-2-(1H-pyrazol-3-yl)phenol
CID 5068606
4-(4-Phenyl-5-(trifluoromethyl)-1H-pyrazol-3-YL)-1,3-benzenediol
CID 939600
2-[5-(2-Fluorophenyl)-1H-pyrazol-3-yl]phenol
CID 136226476
2-[5-(1,1,2,2-tetrafluoroethyl)-1H-pyrazol-3-yl]phenol
CID 762936
2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]phenol
CID 699643
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
2-[5-(4-Fluoro-phenyl)-1H-pyrazol-3-yl]-5-methyl-phenol
CID 781217
2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-5-methylphenol
CID 755039
2-(5-phenyl-1H-pyrazol-3-yl)phenol
CID 781202

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol?
The IUPAC name of 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol (CID 759784) is 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol.
What is the SMILES notation for 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol?
The canonical SMILES for 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol is Oc1ccccc1-c1cc(-c2ccc(F)cc2)n[nH]1.
What is the InChIKey of 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol?
The InChIKey is PCCNBBWUCGTENW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O/c16-11-7-5-10(6-8-11)13-9-14(18-17-13)12-3-1-2-4-15(12)19/h1-9,19H,(H,17,18).
What are the key properties of 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol?
2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol has a molecular weight of 254.26 g/mol, XLogP of 3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]phenol is sourced from PubChem (CID 759784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).