2-(4-phenoxyphenyl)piperazine

C16H18N2O — CID 82298874

IUPAC2-(4-phenoxyphenyl)piperazine
SMILESc1ccc(Oc2ccc(C3CNCCN3)cc2)cc1
InChIInChI=1S/C16H18N2O/c1-2-4-14(5-3-1)19-15-8-6-13(7-9-15)16-12-17-10-11-18-16/h1-9,16-18H,10-12H2
InChIKeyNASNNRDIVCZETE-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.71
Rot. Bonds3

About 2-(4-phenoxyphenyl)piperazine

2-(4-phenoxyphenyl)piperazine (PubChem CID 82298874) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(4-phenoxyphenyl)piperazine.

Molecular Properties

Compound Name2-(4-phenoxyphenyl)piperazine
PubChem CID82298874
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-(4-phenoxyphenyl)piperazine
SMILESc1ccc(Oc2ccc(C3CNCCN3)cc2)cc1
InChIInChI=1S/C16H18N2O/c1-2-4-14(5-3-1)19-15-8-6-13(7-9-15)16-12-17-10-11-18-16/h1-9,16-18H,10-12H2
InChIKeyNASNNRDIVCZETE-UHFFFAOYSA-N
XLogP2.71
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(3-phenoxyphenyl)piperazine;hydrochloride
CID 171194229
2-phenyl-1,4,7,10-tetrazacyclododecane
CID 10901007
(2R)-2-(4-propan-2-yloxyphenyl)piperazine
CID 95443937
2-[4-(2-methylpropoxy)phenyl]piperazine
CID 82290919
[4-[(2S)-piperazin-2-yl]phenyl] acetate;hydrochloride
CID 171193891
3-methyl-4-(4-piperazin-2-ylphenoxy)-1H-pyrrolo[2,3-b]pyridine
CID 155386650
(2S)-2-(3-phenylmethoxyphenyl)piperazine;hydrochloride
CID 171193942
2-(4-methoxyphenyl)-1,4-diazocane
CID 2771778
2-(4-ethylphenyl)piperazine
CID 45036830
2-pyridin-3-ylpiperazine
CID 3872289
(2R)-2-(9H-fluoren-2-yl)piperazine
CID 171194655
(2S)-2-[4-(methoxymethyl)phenyl]piperazine
CID 67928117

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenoxyphenyl)piperazine?
The IUPAC name of 2-(4-phenoxyphenyl)piperazine (CID 82298874) is 2-(4-phenoxyphenyl)piperazine.
What is the SMILES notation for 2-(4-phenoxyphenyl)piperazine?
The canonical SMILES for 2-(4-phenoxyphenyl)piperazine is c1ccc(Oc2ccc(C3CNCCN3)cc2)cc1.
What is the InChIKey of 2-(4-phenoxyphenyl)piperazine?
The InChIKey is NASNNRDIVCZETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-2-4-14(5-3-1)19-15-8-6-13(7-9-15)16-12-17-10-11-18-16/h1-9,16-18H,10-12H2.
What are the key properties of 2-(4-phenoxyphenyl)piperazine?
2-(4-phenoxyphenyl)piperazine has a molecular weight of 254.33 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenoxyphenyl)piperazine is sourced from PubChem (CID 82298874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).