1-[4-(4-fluorophenyl)cyclohexyl]piperazine

C16H23FN2 — CID 22122079

IUPAC1-[4-(4-fluorophenyl)cyclohexyl]piperazine
SMILESFc1ccc(C2CCC(N3CCNCC3)CC2)cc1
InChIInChI=1S/C16H23FN2/c17-15-5-1-13(2-6-15)14-3-7-16(8-4-14)19-11-9-18-10-12-19/h1-2,5-6,14,16,18H,3-4,7-12H2
InChIKeyIOYBJWDVUOWOAF-UHFFFAOYSA-N
MW262.37 g/mol
LogP2.76
Rot. Bonds2

About 1-[4-(4-fluorophenyl)cyclohexyl]piperazine

1-[4-(4-fluorophenyl)cyclohexyl]piperazine (PubChem CID 22122079) has the molecular formula C16H23FN2 and a molecular weight of 262.37 g/mol. Its IUPAC name is 1-[4-(4-fluorophenyl)cyclohexyl]piperazine.

Molecular Properties

Compound Name1-[4-(4-fluorophenyl)cyclohexyl]piperazine
PubChem CID22122079
Molecular FormulaC16H23FN2
Molecular Weight262.37 g/mol
Exact Mass262.18
IUPAC Name1-[4-(4-fluorophenyl)cyclohexyl]piperazine
SMILESFc1ccc(C2CCC(N3CCNCC3)CC2)cc1
InChIInChI=1S/C16H23FN2/c17-15-5-1-13(2-6-15)14-3-7-16(8-4-14)19-11-9-18-10-12-19/h1-2,5-6,14,16,18H,3-4,7-12H2
InChIKeyIOYBJWDVUOWOAF-UHFFFAOYSA-N
XLogP2.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-fluorophenyl)cyclohexyl]piperazine?
The IUPAC name of 1-[4-(4-fluorophenyl)cyclohexyl]piperazine (CID 22122079) is 1-[4-(4-fluorophenyl)cyclohexyl]piperazine.
What is the SMILES notation for 1-[4-(4-fluorophenyl)cyclohexyl]piperazine?
The canonical SMILES for 1-[4-(4-fluorophenyl)cyclohexyl]piperazine is Fc1ccc(C2CCC(N3CCNCC3)CC2)cc1.
What is the InChIKey of 1-[4-(4-fluorophenyl)cyclohexyl]piperazine?
The InChIKey is IOYBJWDVUOWOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2/c17-15-5-1-13(2-6-15)14-3-7-16(8-4-14)19-11-9-18-10-12-19/h1-2,5-6,14,16,18H,3-4,7-12H2.
What are the key properties of 1-[4-(4-fluorophenyl)cyclohexyl]piperazine?
1-[4-(4-fluorophenyl)cyclohexyl]piperazine has a molecular weight of 262.37 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-fluorophenyl)cyclohexyl]piperazine is sourced from PubChem (CID 22122079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).