(2R)-2-(3-fluorophenoxy)-1-phenylpiperazine

C16H17FN2O — CID 90982921

IUPAC(2R)-2-(3-fluorophenoxy)-1-phenylpiperazine
SMILESFc1cccc(O[C@@H]2CNCCN2c2ccccc2)c1
InChIInChI=1S/C16H17FN2O/c17-13-5-4-8-15(11-13)20-16-12-18-9-10-19(16)14-6-2-1-3-7-14/h1-8,11,16,18H,9-10,12H2/t16-/m1/s1
InChIKeyCZDNLIGVUAUBDZ-MRXNPFEDSA-N
MW272.32 g/mol
LogP2.64
Rot. Bonds3

About (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine

(2R)-2-(3-fluorophenoxy)-1-phenylpiperazine (PubChem CID 90982921) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine.

Molecular Properties

Compound Name(2R)-2-(3-fluorophenoxy)-1-phenylpiperazine
PubChem CID90982921
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name(2R)-2-(3-fluorophenoxy)-1-phenylpiperazine
SMILESFc1cccc(O[C@@H]2CNCCN2c2ccccc2)c1
InChIInChI=1S/C16H17FN2O/c17-13-5-4-8-15(11-13)20-16-12-18-9-10-19(16)14-6-2-1-3-7-14/h1-8,11,16,18H,9-10,12H2/t16-/m1/s1
InChIKeyCZDNLIGVUAUBDZ-MRXNPFEDSA-N
XLogP2.64
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine?
The IUPAC name of (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine (CID 90982921) is (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine.
What is the SMILES notation for (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine?
The canonical SMILES for (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine is Fc1cccc(O[C@@H]2CNCCN2c2ccccc2)c1.
What is the InChIKey of (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine?
The InChIKey is CZDNLIGVUAUBDZ-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H17FN2O/c17-13-5-4-8-15(11-13)20-16-12-18-9-10-19(16)14-6-2-1-3-7-14/h1-8,11,16,18H,9-10,12H2/t16-/m1/s1.
What are the key properties of (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine?
(2R)-2-(3-fluorophenoxy)-1-phenylpiperazine has a molecular weight of 272.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-fluorophenoxy)-1-phenylpiperazine is sourced from PubChem (CID 90982921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).