1-[4-(4-ethylphenyl)phenyl]piperazine

C18H22N2 — CID 82092038

IUPAC1-[4-(4-ethylphenyl)phenyl]piperazine
SMILESCCc1ccc(-c2ccc(N3CCNCC3)cc2)cc1
InChIInChI=1S/C18H22N2/c1-2-15-3-5-16(6-4-15)17-7-9-18(10-8-17)20-13-11-19-12-14-20/h3-10,19H,2,11-14H2,1H3
InChIKeyRNPBZWYUIHXJKN-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.33
Rot. Bonds3

About 1-[4-(4-ethylphenyl)phenyl]piperazine

1-[4-(4-ethylphenyl)phenyl]piperazine (PubChem CID 82092038) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-[4-(4-ethylphenyl)phenyl]piperazine.

Molecular Properties

Compound Name1-[4-(4-ethylphenyl)phenyl]piperazine
PubChem CID82092038
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name1-[4-(4-ethylphenyl)phenyl]piperazine
SMILESCCc1ccc(-c2ccc(N3CCNCC3)cc2)cc1
InChIInChI=1S/C18H22N2/c1-2-15-3-5-16(6-4-15)17-7-9-18(10-8-17)20-13-11-19-12-14-20/h3-10,19H,2,11-14H2,1H3
InChIKeyRNPBZWYUIHXJKN-UHFFFAOYSA-N
XLogP3.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-ethylphenyl)phenyl]piperazine?
The IUPAC name of 1-[4-(4-ethylphenyl)phenyl]piperazine (CID 82092038) is 1-[4-(4-ethylphenyl)phenyl]piperazine.
What is the SMILES notation for 1-[4-(4-ethylphenyl)phenyl]piperazine?
The canonical SMILES for 1-[4-(4-ethylphenyl)phenyl]piperazine is CCc1ccc(-c2ccc(N3CCNCC3)cc2)cc1.
What is the InChIKey of 1-[4-(4-ethylphenyl)phenyl]piperazine?
The InChIKey is RNPBZWYUIHXJKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-2-15-3-5-16(6-4-15)17-7-9-18(10-8-17)20-13-11-19-12-14-20/h3-10,19H,2,11-14H2,1H3.
What are the key properties of 1-[4-(4-ethylphenyl)phenyl]piperazine?
1-[4-(4-ethylphenyl)phenyl]piperazine has a molecular weight of 266.39 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-ethylphenyl)phenyl]piperazine is sourced from PubChem (CID 82092038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).