5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole

C10H9FN2O — CID 83808325

IUPAC5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole
SMILESCOc1cccc(F)c1-c1ccn[nH]1
InChIInChI=1S/C10H9FN2O/c1-14-9-4-2-3-7(11)10(9)8-5-6-12-13-8/h2-6H,1H3,(H,12,13)
InChIKeyHAFGLOQJWGOAHK-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.22
Rot. Bonds2

About 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole

5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole (PubChem CID 83808325) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole
PubChem CID83808325
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole
SMILESCOc1cccc(F)c1-c1ccn[nH]1
InChIInChI=1S/C10H9FN2O/c1-14-9-4-2-3-7(11)10(9)8-5-6-12-13-8/h2-6H,1H3,(H,12,13)
InChIKeyHAFGLOQJWGOAHK-UHFFFAOYSA-N
XLogP2.22
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole?
The IUPAC name of 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole (CID 83808325) is 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole?
The canonical SMILES for 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole is COc1cccc(F)c1-c1ccn[nH]1.
What is the InChIKey of 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole?
The InChIKey is HAFGLOQJWGOAHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-14-9-4-2-3-7(11)10(9)8-5-6-12-13-8/h2-6H,1H3,(H,12,13).
What are the key properties of 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole?
5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole has a molecular weight of 192.19 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-6-methoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 83808325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).