1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine

C22H27FN2 — CID 784317

IUPAC1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine
SMILESFc1ccc(N2CCN(C3CCC(c4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C22H27FN2/c23-20-8-12-22(13-9-20)25-16-14-24(15-17-25)21-10-6-19(7-11-21)18-4-2-1-3-5-18/h1-5,8-9,12-13,19,21H,6-7,10-11,14-17H2
InChIKeyGAHQOFZHLMSQFD-UHFFFAOYSA-N
MW338.47 g/mol
LogP4.67
Rot. Bonds3

About 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine

1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine (PubChem CID 784317) has the molecular formula C22H27FN2 and a molecular weight of 338.47 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine
PubChem CID784317
Molecular FormulaC22H27FN2
Molecular Weight338.47 g/mol
Exact Mass338.22
IUPAC Name1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine
SMILESFc1ccc(N2CCN(C3CCC(c4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C22H27FN2/c23-20-8-12-22(13-9-20)25-16-14-24(15-17-25)21-10-6-19(7-11-21)18-4-2-1-3-5-18/h1-5,8-9,12-13,19,21H,6-7,10-11,14-17H2
InChIKeyGAHQOFZHLMSQFD-UHFFFAOYSA-N
XLogP4.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.47
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine?
The IUPAC name of 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine (CID 784317) is 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine.
What is the SMILES notation for 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine?
The canonical SMILES for 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine is Fc1ccc(N2CCN(C3CCC(c4ccccc4)CC3)CC2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine?
The InChIKey is GAHQOFZHLMSQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27FN2/c23-20-8-12-22(13-9-20)25-16-14-24(15-17-25)21-10-6-19(7-11-21)18-4-2-1-3-5-18/h1-5,8-9,12-13,19,21H,6-7,10-11,14-17H2.
What are the key properties of 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine?
1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine has a molecular weight of 338.47 g/mol, XLogP of 4.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-4-(4-phenylcyclohexyl)piperazine is sourced from PubChem (CID 784317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).