4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole

C11H9FN2 — CID 15812250

IUPAC4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole
SMILESF/C(=C\c1ccccc1)c1cn[nH]c1
InChIInChI=1S/C11H9FN2/c12-11(10-7-13-14-8-10)6-9-4-2-1-3-5-9/h1-8H,(H,13,14)/b11-6-
InChIKeyWDIPPBDHRZMBDC-WDZFZDKYSA-N
MW188.21 g/mol
LogP2.88
Rot. Bonds2

About 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole

4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole (PubChem CID 15812250) has the molecular formula C11H9FN2 and a molecular weight of 188.21 g/mol. Its IUPAC name is 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole.

Molecular Properties

Compound Name4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole
PubChem CID15812250
Molecular FormulaC11H9FN2
Molecular Weight188.21 g/mol
Exact Mass188.07
IUPAC Name4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole
SMILESF/C(=C\c1ccccc1)c1cn[nH]c1
InChIInChI=1S/C11H9FN2/c12-11(10-7-13-14-8-10)6-9-4-2-1-3-5-9/h1-8H,(H,13,14)/b11-6-
InChIKeyWDIPPBDHRZMBDC-WDZFZDKYSA-N
XLogP2.88
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 ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole?
The IUPAC name of 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole (CID 15812250) is 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole.
What is the SMILES notation for 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole?
The canonical SMILES for 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole is F/C(=C\c1ccccc1)c1cn[nH]c1.
What is the InChIKey of 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole?
The InChIKey is WDIPPBDHRZMBDC-WDZFZDKYSA-N. The full InChI is InChI=1S/C11H9FN2/c12-11(10-7-13-14-8-10)6-9-4-2-1-3-5-9/h1-8H,(H,13,14)/b11-6-.
What are the key properties of 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole?
4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole has a molecular weight of 188.21 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-fluoro-2-phenylethenyl]-1H-pyrazole is sourced from PubChem (CID 15812250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).