1-[3-(3-fluorophenyl)phenyl]piperazine

C16H17FN2 — CID 82088997

IUPAC1-[3-(3-fluorophenyl)phenyl]piperazine
SMILESFc1cccc(-c2cccc(N3CCNCC3)c2)c1
InChIInChI=1S/C16H17FN2/c17-15-5-1-3-13(11-15)14-4-2-6-16(12-14)19-9-7-18-8-10-19/h1-6,11-12,18H,7-10H2
InChIKeyCKQTUQOIELUSQX-UHFFFAOYSA-N
MW256.32 g/mol
LogP2.90
Rot. Bonds2

About 1-[3-(3-fluorophenyl)phenyl]piperazine

1-[3-(3-fluorophenyl)phenyl]piperazine (PubChem CID 82088997) has the molecular formula C16H17FN2 and a molecular weight of 256.32 g/mol. Its IUPAC name is 1-[3-(3-fluorophenyl)phenyl]piperazine.

Molecular Properties

Compound Name1-[3-(3-fluorophenyl)phenyl]piperazine
PubChem CID82088997
Molecular FormulaC16H17FN2
Molecular Weight256.32 g/mol
Exact Mass256.14
IUPAC Name1-[3-(3-fluorophenyl)phenyl]piperazine
SMILESFc1cccc(-c2cccc(N3CCNCC3)c2)c1
InChIInChI=1S/C16H17FN2/c17-15-5-1-3-13(11-15)14-4-2-6-16(12-14)19-9-7-18-8-10-19/h1-6,11-12,18H,7-10H2
InChIKeyCKQTUQOIELUSQX-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(4-fluoro-3-methylphenyl)phenyl]piperazine;hydrochloride
CID 154914779
1-[3-fluoro-5-[3-(trifluoromethyl)phenyl]phenyl]piperazine
CID 11558854
1-(3-pyridin-3-ylphenyl)piperazine
CID 150431219
1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine
CID 31074314
3-methyl-5-(3-piperazin-1-ylphenyl)pyridin-2-amine
CID 72877578
6-fluoro-8-(3-piperazin-1-ylphenyl)quinoline;hydrochloride
CID 154914716
1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine
CID 11708865
(3-piperazin-1-ylphenyl)methanamine
CID 83775094
1-[3-(trifluoromethylsulfanyl)phenyl]piperazine
CID 3016557
1-(3-ethylphenyl)piperazine;hydrochloride
CID 19911472
1-(3,4-difluorophenyl)piperazine
CID 2783122
(1R)-2,2,2-trifluoro-1-(3-piperazin-1-ylphenyl)ethanamine
CID 66510325

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3-fluorophenyl)phenyl]piperazine?
The IUPAC name of 1-[3-(3-fluorophenyl)phenyl]piperazine (CID 82088997) is 1-[3-(3-fluorophenyl)phenyl]piperazine.
What is the SMILES notation for 1-[3-(3-fluorophenyl)phenyl]piperazine?
The canonical SMILES for 1-[3-(3-fluorophenyl)phenyl]piperazine is Fc1cccc(-c2cccc(N3CCNCC3)c2)c1.
What is the InChIKey of 1-[3-(3-fluorophenyl)phenyl]piperazine?
The InChIKey is CKQTUQOIELUSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2/c17-15-5-1-3-13(11-15)14-4-2-6-16(12-14)19-9-7-18-8-10-19/h1-6,11-12,18H,7-10H2.
What are the key properties of 1-[3-(3-fluorophenyl)phenyl]piperazine?
1-[3-(3-fluorophenyl)phenyl]piperazine has a molecular weight of 256.32 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3-fluorophenyl)phenyl]piperazine is sourced from PubChem (CID 82088997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).