5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole

C11H9FN2 — CID 173291602

IUPAC5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole
SMILESFc1ccccc1C=Cc1ccn[nH]1
InChIInChI=1S/C11H9FN2/c12-11-4-2-1-3-9(11)5-6-10-7-8-13-14-10/h1-8H,(H,13,14)
InChIKeyICOUARQLAVKJCW-UHFFFAOYSA-N
MW188.21 g/mol
LogP2.72
Rot. Bonds2

About 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole

5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole (PubChem CID 173291602) has the molecular formula C11H9FN2 and a molecular weight of 188.21 g/mol. Its IUPAC name is 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole.

Molecular Properties

Compound Name5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole
PubChem CID173291602
Molecular FormulaC11H9FN2
Molecular Weight188.21 g/mol
Exact Mass188.07
IUPAC Name5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole
SMILESFc1ccccc1C=Cc1ccn[nH]1
InChIInChI=1S/C11H9FN2/c12-11-4-2-1-3-9(11)5-6-10-7-8-13-14-10/h1-8H,(H,13,14)
InChIKeyICOUARQLAVKJCW-UHFFFAOYSA-N
XLogP2.72
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.21
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;5-[(E)-2-phenylethenyl]-1H-pyrazole
CID 90810948
4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine
CID 6327980
1-fluoro-2-[(Z)-2-phenylethenyl]benzene
CID 46218050
5-(2-naphthalen-2-ylethenyl)-1H-pyrazole
CID 66960480
5-[(Z)-2-naphthalen-2-ylethenyl]-1H-pyrazole
CID 44609560
5-(2-thiophen-3-ylethenyl)-1H-pyrazole
CID 66979124
cyclobutane;2-[2-(2-fluorophenyl)ethenyl]pyridine
CID 175276966
5-[(Z)-2-[2-chloro-4-(trifluoromethyl)phenyl]ethenyl]-1H-pyrazole
CID 50942903
(E)-3-(2-fluorophenyl)prop-2-enenitrile
CID 11062531
1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene
CID 134146382
1-but-1-en-3-ynyl-2-fluorobenzene
CID 123247882
4-[(E)-2-(2-fluorophenyl)ethenyl]cinnoline
CID 6411449

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole?
The IUPAC name of 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole (CID 173291602) is 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole.
What is the SMILES notation for 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole?
The canonical SMILES for 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole is Fc1ccccc1C=Cc1ccn[nH]1.
What is the InChIKey of 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole?
The InChIKey is ICOUARQLAVKJCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2/c12-11-4-2-1-3-9(11)5-6-10-7-8-13-14-10/h1-8H,(H,13,14).
What are the key properties of 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole?
5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole has a molecular weight of 188.21 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-fluorophenyl)ethenyl]-1H-pyrazole is sourced from PubChem (CID 173291602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).