1-(4-Fluorophenyl)piperazine

C10H13FN2 — CID 75260

IUPAC1-(4-fluorophenyl)piperazine
SMILESC1CN(CCN1)C2=CC=C(C=C2)F
InChIInChI=1S/C10H13FN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
InChIKeyAVJKDKWRVSSJPK-UHFFFAOYSA-N
MW180.22 g/mol
LogP1.30
Rot. Bonds1

About 1-(4-Fluorophenyl)piperazine

1-(4-Fluorophenyl)piperazine (PubChem CID 75260) has the molecular formula C10H13FN2 and a molecular weight of 180.22 g/mol. Its IUPAC name is 1-(4-fluorophenyl)piperazine.

Molecular Properties

Compound Name1-(4-Fluorophenyl)piperazine
PubChem CID75260
Molecular FormulaC10H13FN2
Molecular Weight180.22 g/mol
Exact Mass180.11
IUPAC Name1-(4-fluorophenyl)piperazine
SMILESC1CN(CCN1)C2=CC=C(C=C2)F
InChIInChI=1S/C10H13FN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
InChIKeyAVJKDKWRVSSJPK-UHFFFAOYSA-N
XLogP1.30
TPSA15.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity149

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-Fluorophenyl)piperazine 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-(3-(Trifluoromethyl)phenyl)piperazine
CID 4296
N-Ethylaniline
CID 7670
1-(3-Chlorophenyl)piperazine
CID 1355
N-Isopropylaniline
CID 13032
1-Phenylpiperazine
CID 7096
N,N'-Di-sec-butyl-p-phenylenediamine
CID 7589
1,1-Dimethyl-4-phenylpiperazinium iodide
CID 5911
1-(3-Chlorophenyl)piperazine monohydrochloride
CID 25681
N-Butylaniline
CID 14310
1-(2-Fluorophenyl)piperazine
CID 70529
N,N'-Diphenylethylenediamine
CID 67422
1,2-Ethanediamine, N1-ethyl-N2,N2-dimethyl-N1-phenyl-
CID 33984

Frequently Asked Questions

What is the IUPAC name of 1-(4-Fluorophenyl)piperazine?
The IUPAC name of 1-(4-Fluorophenyl)piperazine (CID 75260) is 1-(4-fluorophenyl)piperazine.
What is the SMILES notation for 1-(4-Fluorophenyl)piperazine?
The canonical SMILES for 1-(4-Fluorophenyl)piperazine is C1CN(CCN1)C2=CC=C(C=C2)F.
What is the InChIKey of 1-(4-Fluorophenyl)piperazine?
The InChIKey is AVJKDKWRVSSJPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2.
What are the key properties of 1-(4-Fluorophenyl)piperazine?
1-(4-Fluorophenyl)piperazine has a molecular weight of 180.22 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-Fluorophenyl)piperazine is sourced from PubChem (CID 75260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).