1-[2-(4-phenylphenoxy)ethyl]imidazole

C17H16N2O — CID 2995330

IUPAC1-[2-(4-phenylphenoxy)ethyl]imidazole
SMILESc1ccc(-c2ccc(OCCn3ccnc3)cc2)cc1
InChIInChI=1S/C17H16N2O/c1-2-4-15(5-3-1)16-6-8-17(9-7-16)20-13-12-19-11-10-18-14-19/h1-11,14H,12-13H2
InChIKeySWUXHIDBUWCREV-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.63
Rot. Bonds5

About 1-[2-(4-phenylphenoxy)ethyl]imidazole

1-[2-(4-phenylphenoxy)ethyl]imidazole (PubChem CID 2995330) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-[2-(4-phenylphenoxy)ethyl]imidazole.

Molecular Properties

Compound Name1-[2-(4-phenylphenoxy)ethyl]imidazole
PubChem CID2995330
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name1-[2-(4-phenylphenoxy)ethyl]imidazole
SMILESc1ccc(-c2ccc(OCCn3ccnc3)cc2)cc1
InChIInChI=1S/C17H16N2O/c1-2-4-15(5-3-1)16-6-8-17(9-7-16)20-13-12-19-11-10-18-14-19/h1-11,14H,12-13H2
InChIKeySWUXHIDBUWCREV-UHFFFAOYSA-N
XLogP3.63
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-phenylphenoxy)ethyl]imidazole?
The IUPAC name of 1-[2-(4-phenylphenoxy)ethyl]imidazole (CID 2995330) is 1-[2-(4-phenylphenoxy)ethyl]imidazole.
What is the SMILES notation for 1-[2-(4-phenylphenoxy)ethyl]imidazole?
The canonical SMILES for 1-[2-(4-phenylphenoxy)ethyl]imidazole is c1ccc(-c2ccc(OCCn3ccnc3)cc2)cc1.
What is the InChIKey of 1-[2-(4-phenylphenoxy)ethyl]imidazole?
The InChIKey is SWUXHIDBUWCREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-2-4-15(5-3-1)16-6-8-17(9-7-16)20-13-12-19-11-10-18-14-19/h1-11,14H,12-13H2.
What are the key properties of 1-[2-(4-phenylphenoxy)ethyl]imidazole?
1-[2-(4-phenylphenoxy)ethyl]imidazole has a molecular weight of 264.33 g/mol, XLogP of 3.63, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-phenylphenoxy)ethyl]imidazole is sourced from PubChem (CID 2995330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).