2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol

C23H20N2O — CID 13013640

IUPAC2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol
SMILESOC(Cn1ccnc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H20N2O/c26-23(17-25-16-15-24-18-25,21-9-5-2-6-10-21)22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-16,18,26H,17H2
InChIKeyCIRGFUJDXVYLJS-UHFFFAOYSA-N
MW340.43 g/mol
LogP4.49
Rot. Bonds5

About 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol

2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol (PubChem CID 13013640) has the molecular formula C23H20N2O and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol.

Molecular Properties

Compound Name2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol
PubChem CID13013640
Molecular FormulaC23H20N2O
Molecular Weight340.43 g/mol
Exact Mass340.16
IUPAC Name2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol
SMILESOC(Cn1ccnc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H20N2O/c26-23(17-25-16-15-24-18-25,21-9-5-2-6-10-21)22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-16,18,26H,17H2
InChIKeyCIRGFUJDXVYLJS-UHFFFAOYSA-N
XLogP4.49
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol?
The IUPAC name of 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol (CID 13013640) is 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol.
What is the SMILES notation for 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol?
The canonical SMILES for 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol is OC(Cn1ccnc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol?
The InChIKey is CIRGFUJDXVYLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O/c26-23(17-25-16-15-24-18-25,21-9-5-2-6-10-21)22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-16,18,26H,17H2.
What are the key properties of 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol?
2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol has a molecular weight of 340.43 g/mol, XLogP of 4.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol is sourced from PubChem (CID 13013640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).