2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole

C17H16N2O — CID 91469919

IUPAC2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole
SMILESCOc1ccc(-c2ccccc2)c(Cc2ncc[nH]2)c1
InChIInChI=1S/C17H16N2O/c1-20-15-7-8-16(13-5-3-2-4-6-13)14(11-15)12-17-18-9-10-19-17/h2-11H,12H2,1H3,(H,18,19)
InChIKeyGACAHMBSDNXLHT-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.68
Rot. Bonds4

About 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole

2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole (PubChem CID 91469919) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole.

Molecular Properties

Compound Name2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole
PubChem CID91469919
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole
SMILESCOc1ccc(-c2ccccc2)c(Cc2ncc[nH]2)c1
InChIInChI=1S/C17H16N2O/c1-20-15-7-8-16(13-5-3-2-4-6-13)14(11-15)12-17-18-9-10-19-17/h2-11H,12H2,1H3,(H,18,19)
InChIKeyGACAHMBSDNXLHT-UHFFFAOYSA-N
XLogP3.68
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole?
The IUPAC name of 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole (CID 91469919) is 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole.
What is the SMILES notation for 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole?
The canonical SMILES for 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole is COc1ccc(-c2ccccc2)c(Cc2ncc[nH]2)c1.
What is the InChIKey of 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole?
The InChIKey is GACAHMBSDNXLHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-20-15-7-8-16(13-5-3-2-4-6-13)14(11-15)12-17-18-9-10-19-17/h2-11H,12H2,1H3,(H,18,19).
What are the key properties of 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole?
2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole has a molecular weight of 264.33 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methoxy-2-phenylphenyl)methyl]-1H-imidazole is sourced from PubChem (CID 91469919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).