5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole

C19H15FN2S — CID 18175524

IUPAC5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole
SMILESFc1ccc(-c2ccc(C3CC(c4cccs4)=NN3)cc2)cc1
InChIInChI=1S/C19H15FN2S/c20-16-9-7-14(8-10-16)13-3-5-15(6-4-13)17-12-18(22-21-17)19-2-1-11-23-19/h1-11,17,21H,12H2
InChIKeyGPZWFQPBFPOHNB-UHFFFAOYSA-N
MW322.41 g/mol
LogP4.99
Rot. Bonds3

About 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole

5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole (PubChem CID 18175524) has the molecular formula C19H15FN2S and a molecular weight of 322.41 g/mol. Its IUPAC name is 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole.

Molecular Properties

Compound Name5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole
PubChem CID18175524
Molecular FormulaC19H15FN2S
Molecular Weight322.41 g/mol
Exact Mass322.09
IUPAC Name5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole
SMILESFc1ccc(-c2ccc(C3CC(c4cccs4)=NN3)cc2)cc1
InChIInChI=1S/C19H15FN2S/c20-16-9-7-14(8-10-16)13-3-5-15(6-4-13)17-12-18(22-21-17)19-2-1-11-23-19/h1-11,17,21H,12H2
InChIKeyGPZWFQPBFPOHNB-UHFFFAOYSA-N
XLogP4.99
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole?
The IUPAC name of 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole (CID 18175524) is 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole.
What is the SMILES notation for 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole?
The canonical SMILES for 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole is Fc1ccc(-c2ccc(C3CC(c4cccs4)=NN3)cc2)cc1.
What is the InChIKey of 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole?
The InChIKey is GPZWFQPBFPOHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2S/c20-16-9-7-14(8-10-16)13-3-5-15(6-4-13)17-12-18(22-21-17)19-2-1-11-23-19/h1-11,17,21H,12H2.
What are the key properties of 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole?
5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole has a molecular weight of 322.41 g/mol, XLogP of 4.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-fluorophenyl)phenyl]-3-thiophen-2-yl-4,5-dihydro-1H-pyrazole is sourced from PubChem (CID 18175524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).