1-benzhydryl-4-(2-phenylethyl)piperazine

C25H28N2 — CID 71411866

IUPAC1-benzhydryl-4-(2-phenylethyl)piperazine
SMILESc1ccc(CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1
InChIInChI=1S/C25H28N2/c1-4-10-22(11-5-1)16-17-26-18-20-27(21-19-26)25(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,25H,16-21H2
InChIKeyDZTIFSFZEQLBLH-UHFFFAOYSA-N
MW356.51 g/mol
LogP4.64
Rot. Bonds6

About 1-benzhydryl-4-(2-phenylethyl)piperazine

1-benzhydryl-4-(2-phenylethyl)piperazine (PubChem CID 71411866) has the molecular formula C25H28N2 and a molecular weight of 356.51 g/mol. Its IUPAC name is 1-benzhydryl-4-(2-phenylethyl)piperazine.

Molecular Properties

Compound Name1-benzhydryl-4-(2-phenylethyl)piperazine
PubChem CID71411866
Molecular FormulaC25H28N2
Molecular Weight356.51 g/mol
Exact Mass356.23
IUPAC Name1-benzhydryl-4-(2-phenylethyl)piperazine
SMILESc1ccc(CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1
InChIInChI=1S/C25H28N2/c1-4-10-22(11-5-1)16-17-26-18-20-27(21-19-26)25(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,25H,16-21H2
InChIKeyDZTIFSFZEQLBLH-UHFFFAOYSA-N
XLogP4.64
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-benzhydryl-4-(2-phenylethyl)piperazine?
The IUPAC name of 1-benzhydryl-4-(2-phenylethyl)piperazine (CID 71411866) is 1-benzhydryl-4-(2-phenylethyl)piperazine.
What is the SMILES notation for 1-benzhydryl-4-(2-phenylethyl)piperazine?
The canonical SMILES for 1-benzhydryl-4-(2-phenylethyl)piperazine is c1ccc(CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1.
What is the InChIKey of 1-benzhydryl-4-(2-phenylethyl)piperazine?
The InChIKey is DZTIFSFZEQLBLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2/c1-4-10-22(11-5-1)16-17-26-18-20-27(21-19-26)25(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,25H,16-21H2.
What are the key properties of 1-benzhydryl-4-(2-phenylethyl)piperazine?
1-benzhydryl-4-(2-phenylethyl)piperazine has a molecular weight of 356.51 g/mol, XLogP of 4.64, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydryl-4-(2-phenylethyl)piperazine is sourced from PubChem (CID 71411866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).