5-fluoro-3-thiophen-2-yl-1H-pyrazole

C7H5FN2S — CID 143883321

IUPAC5-fluoro-3-thiophen-2-yl-1H-pyrazole
SMILESFc1cc(-c2cccs2)n[nH]1
InChIInChI=1S/C7H5FN2S/c8-7-4-5(9-10-7)6-2-1-3-11-6/h1-4H,(H,9,10)
InChIKeyGVSSKNZQUWKWAW-UHFFFAOYSA-N
MW168.20 g/mol
LogP2.28
Rot. Bonds1

About 5-fluoro-3-thiophen-2-yl-1H-pyrazole

5-fluoro-3-thiophen-2-yl-1H-pyrazole (PubChem CID 143883321) has the molecular formula C7H5FN2S and a molecular weight of 168.20 g/mol. Its IUPAC name is 5-fluoro-3-thiophen-2-yl-1H-pyrazole.

Molecular Properties

Compound Name5-fluoro-3-thiophen-2-yl-1H-pyrazole
PubChem CID143883321
Molecular FormulaC7H5FN2S
Molecular Weight168.20 g/mol
Exact Mass168.02
IUPAC Name5-fluoro-3-thiophen-2-yl-1H-pyrazole
SMILESFc1cc(-c2cccs2)n[nH]1
InChIInChI=1S/C7H5FN2S/c8-7-4-5(9-10-7)6-2-1-3-11-6/h1-4H,(H,9,10)
InChIKeyGVSSKNZQUWKWAW-UHFFFAOYSA-N
XLogP2.28
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-thiophen-2-yl-1H-pyrazole?
The IUPAC name of 5-fluoro-3-thiophen-2-yl-1H-pyrazole (CID 143883321) is 5-fluoro-3-thiophen-2-yl-1H-pyrazole.
What is the SMILES notation for 5-fluoro-3-thiophen-2-yl-1H-pyrazole?
The canonical SMILES for 5-fluoro-3-thiophen-2-yl-1H-pyrazole is Fc1cc(-c2cccs2)n[nH]1.
What is the InChIKey of 5-fluoro-3-thiophen-2-yl-1H-pyrazole?
The InChIKey is GVSSKNZQUWKWAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN2S/c8-7-4-5(9-10-7)6-2-1-3-11-6/h1-4H,(H,9,10).
What are the key properties of 5-fluoro-3-thiophen-2-yl-1H-pyrazole?
5-fluoro-3-thiophen-2-yl-1H-pyrazole has a molecular weight of 168.20 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-thiophen-2-yl-1H-pyrazole is sourced from PubChem (CID 143883321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).