3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole

C17H15FN2O2 — CID 58195290

IUPAC3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole
SMILESCOc1ccccc1-c1cc(OCc2ccc(F)cc2)n[nH]1
InChIInChI=1S/C17H15FN2O2/c1-21-16-5-3-2-4-14(16)15-10-17(20-19-15)22-11-12-6-8-13(18)9-7-12/h2-10H,11H2,1H3,(H,19,20)
InChIKeyZWFXXEZJMYTULD-UHFFFAOYSA-N
MW298.32 g/mol
LogP3.80
Rot. Bonds5

About 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole

3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole (PubChem CID 58195290) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole
PubChem CID58195290
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC Name3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole
SMILESCOc1ccccc1-c1cc(OCc2ccc(F)cc2)n[nH]1
InChIInChI=1S/C17H15FN2O2/c1-21-16-5-3-2-4-14(16)15-10-17(20-19-15)22-11-12-6-8-13(18)9-7-12/h2-10H,11H2,1H3,(H,19,20)
InChIKeyZWFXXEZJMYTULD-UHFFFAOYSA-N
XLogP3.80
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
CID 957472
2-[4-[(4-fluorophenyl)methoxy]-6-methylpyrimidin-2-yl]phenol
CID 781265
5-[(4-fluorophenyl)methoxy]-2-[4-(2-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
CID 135652684
4-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylamino]-3-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione
CID 4726555
5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1H-pyrazol-3-amine
CID 166147884
2-[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]phenol
CID 136622086
1-fluoro-4-[2-[(4-methylphenyl)methoxy]phenyl]benzene
CID 123297454
4-[[2-chloro-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methylamino]-3-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione
CID 66542413
4-fluoro-2-iodo-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]benzamide
CID 56552510
1-fluoro-4-[(3-methoxyphenoxy)methyl]benzene
CID 59165653
1-(4-chlorophenyl)-5-[(4-fluorophenyl)methoxy]-2,4-dimethoxybenzene
CID 91038963
[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
CID 16774045

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole?
The IUPAC name of 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole (CID 58195290) is 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole?
The canonical SMILES for 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole is COc1ccccc1-c1cc(OCc2ccc(F)cc2)n[nH]1.
What is the InChIKey of 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole?
The InChIKey is ZWFXXEZJMYTULD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c1-21-16-5-3-2-4-14(16)15-10-17(20-19-15)22-11-12-6-8-13(18)9-7-12/h2-10H,11H2,1H3,(H,19,20).
What are the key properties of 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole?
3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole has a molecular weight of 298.32 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methoxy]-5-(2-methoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 58195290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).