2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide

C23H19N3O2 — CID 4786512

IUPAC2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide
SMILESO=C(COc1ccc(-n2ccnc2)cc1)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H19N3O2/c27-23(16-28-22-12-10-21(11-13-22)26-15-14-24-17-26)25-20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-15,17H,16H2,(H,25,27)
InChIKeyVHJQAYMEVPBDIB-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.56
Rot. Bonds6

About 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide

2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide (PubChem CID 4786512) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide
PubChem CID4786512
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC Name2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide
SMILESO=C(COc1ccc(-n2ccnc2)cc1)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H19N3O2/c27-23(16-28-22-12-10-21(11-13-22)26-15-14-24-17-26)25-20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-15,17H,16H2,(H,25,27)
InChIKeyVHJQAYMEVPBDIB-UHFFFAOYSA-N
XLogP4.56
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide?
The IUPAC name of 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide (CID 4786512) is 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide.
What is the SMILES notation for 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide?
The canonical SMILES for 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide is O=C(COc1ccc(-n2ccnc2)cc1)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide?
The InChIKey is VHJQAYMEVPBDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c27-23(16-28-22-12-10-21(11-13-22)26-15-14-24-17-26)25-20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-15,17H,16H2,(H,25,27).
What are the key properties of 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide?
2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide has a molecular weight of 369.42 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)acetamide is sourced from PubChem (CID 4786512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).