1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine

C28H29FN4 — CID 25064222

IUPAC1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine
SMILESFc1ccc(-c2cc(CCCN3CCN(c4ccccc4)CC3)nn2-c2ccccc2)cc1
InChIInChI=1S/C28H29FN4/c29-24-15-13-23(14-16-24)28-22-25(30-33(28)27-11-5-2-6-12-27)8-7-17-31-18-20-32(21-19-31)26-9-3-1-4-10-26/h1-6,9-16,22H,7-8,17-21H2
InChIKeyNVYKJXMWCYHQLF-UHFFFAOYSA-N
MW440.57 g/mol
LogP5.43
Rot. Bonds7

About 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine

1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine (PubChem CID 25064222) has the molecular formula C28H29FN4 and a molecular weight of 440.57 g/mol. Its IUPAC name is 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine.

Molecular Properties

Compound Name1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine
PubChem CID25064222
Molecular FormulaC28H29FN4
Molecular Weight440.57 g/mol
Exact Mass440.24
IUPAC Name1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine
SMILESFc1ccc(-c2cc(CCCN3CCN(c4ccccc4)CC3)nn2-c2ccccc2)cc1
InChIInChI=1S/C28H29FN4/c29-24-15-13-23(14-16-24)28-22-25(30-33(28)27-11-5-2-6-12-27)8-7-17-31-18-20-32(21-19-31)26-9-3-1-4-10-26/h1-6,9-16,22H,7-8,17-21H2
InChIKeyNVYKJXMWCYHQLF-UHFFFAOYSA-N
XLogP5.43
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.57
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,3-dimethylphenyl)-4-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]piperazine
CID 25064429
1-[3-[5-(4-chlorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-(2-fluorophenyl)piperazine
CID 25066913
1-(2,4-dimethylphenyl)-4-[3-(1,5-diphenylpyrazol-3-yl)propyl]piperazine
CID 25065047
1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-phenylpiperazine
CID 25065259
1-[3-[1-tert-butyl-5-(4-methoxyphenyl)pyrazol-3-yl]propyl]-4-phenylpiperazine
CID 25065874
1-(4-chlorophenyl)-4-[3-(1-phenyl-5-propylpyrazol-3-yl)propyl]piperazine
CID 68557259
3-(4-fluorophenyl)-1,5-diphenylpyrazole
CID 14978147
ethane;5-methyl-3-[3-(4-phenylpiperazin-1-yl)propyl]-1,2-oxazole
CID 177319242
1-[3-[3-butyl-1-(4-methylphenyl)pyrazol-5-yl]propyl]-4-(2-fluorophenyl)piperazine
CID 68559610
1-(3,4-dimethylphenyl)-4-[3-(1-phenyl-3-propylpyrazol-5-yl)propyl]piperazine;hydrochloride
CID 71766546
5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-4-phenyl-1,3-thiazol-2-amine
CID 19982248
1-(4-fluorophenyl)-4-[2-(5-phenyltriazol-1-yl)ethyl]piperazine;hydrochloride
CID 142709666

Frequently Asked Questions

What is the IUPAC name of 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine?
The IUPAC name of 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine (CID 25064222) is 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine.
What is the SMILES notation for 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine?
The canonical SMILES for 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine is Fc1ccc(-c2cc(CCCN3CCN(c4ccccc4)CC3)nn2-c2ccccc2)cc1.
What is the InChIKey of 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine?
The InChIKey is NVYKJXMWCYHQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29FN4/c29-24-15-13-23(14-16-24)28-22-25(30-33(28)27-11-5-2-6-12-27)8-7-17-31-18-20-32(21-19-31)26-9-3-1-4-10-26/h1-6,9-16,22H,7-8,17-21H2.
What are the key properties of 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine?
1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine has a molecular weight of 440.57 g/mol, XLogP of 5.43, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[5-(4-fluorophenyl)-1-phenylpyrazol-3-yl]propyl]-4-phenylpiperazine is sourced from PubChem (CID 25064222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).