1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine

C15H20N4 — CID 82514024

IUPAC1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine
SMILESc1ccc(-c2cn(CCN3CCNCC3)cn2)cc1
InChIInChI=1S/C15H20N4/c1-2-4-14(5-3-1)15-12-19(13-17-15)11-10-18-8-6-16-7-9-18/h1-5,12-13,16H,6-11H2
InChIKeyCPDFZGQTBDUBQE-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.46
Rot. Bonds4

About 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine

1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine (PubChem CID 82514024) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine
PubChem CID82514024
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine
SMILESc1ccc(-c2cn(CCN3CCNCC3)cn2)cc1
InChIInChI=1S/C15H20N4/c1-2-4-14(5-3-1)15-12-19(13-17-15)11-10-18-8-6-16-7-9-18/h1-5,12-13,16H,6-11H2
InChIKeyCPDFZGQTBDUBQE-UHFFFAOYSA-N
XLogP1.46
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine?
The IUPAC name of 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine (CID 82514024) is 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine.
What is the SMILES notation for 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine?
The canonical SMILES for 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine is c1ccc(-c2cn(CCN3CCNCC3)cn2)cc1.
What is the InChIKey of 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine?
The InChIKey is CPDFZGQTBDUBQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-2-4-14(5-3-1)15-12-19(13-17-15)11-10-18-8-6-16-7-9-18/h1-5,12-13,16H,6-11H2.
What are the key properties of 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine?
1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine has a molecular weight of 256.35 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-phenylimidazol-1-yl)ethyl]piperazine is sourced from PubChem (CID 82514024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).