1-[(4-methoxyphenyl)methyl]-5-phenylimidazole

C17H16N2O — CID 45103811

IUPAC1-[(4-methoxyphenyl)methyl]-5-phenylimidazole
SMILESCOc1ccc(Cn2cncc2-c2ccccc2)cc1
InChIInChI=1S/C17H16N2O/c1-20-16-9-7-14(8-10-16)12-19-13-18-11-17(19)15-5-3-2-4-6-15/h2-11,13H,12H2,1H3
InChIKeyAZQFSYIIRUWICT-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.61
Rot. Bonds4

About 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole

1-[(4-methoxyphenyl)methyl]-5-phenylimidazole (PubChem CID 45103811) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]-5-phenylimidazole
PubChem CID45103811
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name1-[(4-methoxyphenyl)methyl]-5-phenylimidazole
SMILESCOc1ccc(Cn2cncc2-c2ccccc2)cc1
InChIInChI=1S/C17H16N2O/c1-20-16-9-7-14(8-10-16)12-19-13-18-11-17(19)15-5-3-2-4-6-15/h2-11,13H,12H2,1H3
InChIKeyAZQFSYIIRUWICT-UHFFFAOYSA-N
XLogP3.61
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole (CID 45103811) is 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole is COc1ccc(Cn2cncc2-c2ccccc2)cc1.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole?
The InChIKey is AZQFSYIIRUWICT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-20-16-9-7-14(8-10-16)12-19-13-18-11-17(19)15-5-3-2-4-6-15/h2-11,13H,12H2,1H3.
What are the key properties of 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole?
1-[(4-methoxyphenyl)methyl]-5-phenylimidazole has a molecular weight of 264.33 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]-5-phenylimidazole is sourced from PubChem (CID 45103811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).