5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole

C25H19FN2 — CID 71524961

IUPAC5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole
SMILESFc1ccc(C2=NN(c3ccccc3)C(c3ccc4ccccc4c3)C2)cc1
InChIInChI=1S/C25H19FN2/c26-22-14-12-19(13-15-22)24-17-25(28(27-24)23-8-2-1-3-9-23)21-11-10-18-6-4-5-7-20(18)16-21/h1-16,25H,17H2
InChIKeyHZSFWOABFOFUGI-UHFFFAOYSA-N
MW366.44 g/mol
LogP6.33
Rot. Bonds3

About 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole

5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole (PubChem CID 71524961) has the molecular formula C25H19FN2 and a molecular weight of 366.44 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole
PubChem CID71524961
Molecular FormulaC25H19FN2
Molecular Weight366.44 g/mol
Exact Mass366.15
IUPAC Name5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole
SMILESFc1ccc(C2=NN(c3ccccc3)C(c3ccc4ccccc4c3)C2)cc1
InChIInChI=1S/C25H19FN2/c26-22-14-12-19(13-15-22)24-17-25(28(27-24)23-8-2-1-3-9-23)21-11-10-18-6-4-5-7-20(18)16-21/h1-16,25H,17H2
InChIKeyHZSFWOABFOFUGI-UHFFFAOYSA-N
XLogP6.33
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.44
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole?
The IUPAC name of 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole (CID 71524961) is 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole.
What is the SMILES notation for 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole?
The canonical SMILES for 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole is Fc1ccc(C2=NN(c3ccccc3)C(c3ccc4ccccc4c3)C2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole?
The InChIKey is HZSFWOABFOFUGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2/c26-22-14-12-19(13-15-22)24-17-25(28(27-24)23-8-2-1-3-9-23)21-11-10-18-6-4-5-7-20(18)16-21/h1-16,25H,17H2.
What are the key properties of 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole?
5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole has a molecular weight of 366.44 g/mol, XLogP of 6.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-3-naphthalen-2-yl-2-phenyl-3,4-dihydropyrazole is sourced from PubChem (CID 71524961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).