2-(4-benzhydrylpiperazin-1-yl)phenol

C23H24N2O — CID 2406292

IUPAC2-(4-benzhydrylpiperazin-1-yl)phenol
SMILESOc1ccccc1N1CCN(C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C23H24N2O/c26-22-14-8-7-13-21(22)24-15-17-25(18-16-24)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,23,26H,15-18H2
InChIKeySFICHRHMASLYLU-UHFFFAOYSA-N
MW344.46 g/mol
LogP4.30
Rot. Bonds4

About 2-(4-benzhydrylpiperazin-1-yl)phenol

2-(4-benzhydrylpiperazin-1-yl)phenol (PubChem CID 2406292) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is 2-(4-benzhydrylpiperazin-1-yl)phenol.

Molecular Properties

Compound Name2-(4-benzhydrylpiperazin-1-yl)phenol
PubChem CID2406292
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC Name2-(4-benzhydrylpiperazin-1-yl)phenol
SMILESOc1ccccc1N1CCN(C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C23H24N2O/c26-22-14-8-7-13-21(22)24-15-17-25(18-16-24)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,23,26H,15-18H2
InChIKeySFICHRHMASLYLU-UHFFFAOYSA-N
XLogP4.30
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-benzhydrylpiperazin-1-yl)phenol?
The IUPAC name of 2-(4-benzhydrylpiperazin-1-yl)phenol (CID 2406292) is 2-(4-benzhydrylpiperazin-1-yl)phenol.
What is the SMILES notation for 2-(4-benzhydrylpiperazin-1-yl)phenol?
The canonical SMILES for 2-(4-benzhydrylpiperazin-1-yl)phenol is Oc1ccccc1N1CCN(C(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 2-(4-benzhydrylpiperazin-1-yl)phenol?
The InChIKey is SFICHRHMASLYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O/c26-22-14-8-7-13-21(22)24-15-17-25(18-16-24)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,23,26H,15-18H2.
What are the key properties of 2-(4-benzhydrylpiperazin-1-yl)phenol?
2-(4-benzhydrylpiperazin-1-yl)phenol has a molecular weight of 344.46 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzhydrylpiperazin-1-yl)phenol is sourced from PubChem (CID 2406292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).