1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine

C20H26N2O — CID 11289879

IUPAC1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine
SMILESCCOc1ccccc1CC(c1ccccc1)N1CCNCC1
InChIInChI=1S/C20H26N2O/c1-2-23-20-11-7-6-10-18(20)16-19(17-8-4-3-5-9-17)22-14-12-21-13-15-22/h3-11,19,21H,2,12-16H2,1H3
InChIKeyCVFBVSUFNWOPLD-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.27
Rot. Bonds6

About 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine

1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine (PubChem CID 11289879) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine.

Molecular Properties

Compound Name1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine
PubChem CID11289879
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine
SMILESCCOc1ccccc1CC(c1ccccc1)N1CCNCC1
InChIInChI=1S/C20H26N2O/c1-2-23-20-11-7-6-10-18(20)16-19(17-8-4-3-5-9-17)22-14-12-21-13-15-22/h3-11,19,21H,2,12-16H2,1H3
InChIKeyCVFBVSUFNWOPLD-UHFFFAOYSA-N
XLogP3.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine?
The IUPAC name of 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine (CID 11289879) is 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine.
What is the SMILES notation for 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine?
The canonical SMILES for 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine is CCOc1ccccc1CC(c1ccccc1)N1CCNCC1.
What is the InChIKey of 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine?
The InChIKey is CVFBVSUFNWOPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-2-23-20-11-7-6-10-18(20)16-19(17-8-4-3-5-9-17)22-14-12-21-13-15-22/h3-11,19,21H,2,12-16H2,1H3.
What are the key properties of 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine?
1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine has a molecular weight of 310.44 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethoxyphenyl)-1-phenylethyl]piperazine is sourced from PubChem (CID 11289879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).