1-[bis(4-methoxyphenyl)methyl]imidazole

C18H18N2O2 — CID 10968400

IUPAC1-[bis(4-methoxyphenyl)methyl]imidazole
SMILESCOc1ccc(C(c2ccc(OC)cc2)n2ccnc2)cc1
InChIInChI=1S/C18H18N2O2/c1-21-16-7-3-14(4-8-16)18(20-12-11-19-13-20)15-5-9-17(22-2)10-6-15/h3-13,18H,1-2H3
InChIKeyRJDZAWKSEGPSMJ-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.54
Rot. Bonds5

About 1-[bis(4-methoxyphenyl)methyl]imidazole

1-[bis(4-methoxyphenyl)methyl]imidazole (PubChem CID 10968400) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 1-[bis(4-methoxyphenyl)methyl]imidazole.

Molecular Properties

Compound Name1-[bis(4-methoxyphenyl)methyl]imidazole
PubChem CID10968400
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name1-[bis(4-methoxyphenyl)methyl]imidazole
SMILESCOc1ccc(C(c2ccc(OC)cc2)n2ccnc2)cc1
InChIInChI=1S/C18H18N2O2/c1-21-16-7-3-14(4-8-16)18(20-12-11-19-13-20)15-5-9-17(22-2)10-6-15/h3-13,18H,1-2H3
InChIKeyRJDZAWKSEGPSMJ-UHFFFAOYSA-N
XLogP3.54
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[bis(4-methoxyphenyl)methyl]imidazole?
The IUPAC name of 1-[bis(4-methoxyphenyl)methyl]imidazole (CID 10968400) is 1-[bis(4-methoxyphenyl)methyl]imidazole.
What is the SMILES notation for 1-[bis(4-methoxyphenyl)methyl]imidazole?
The canonical SMILES for 1-[bis(4-methoxyphenyl)methyl]imidazole is COc1ccc(C(c2ccc(OC)cc2)n2ccnc2)cc1.
What is the InChIKey of 1-[bis(4-methoxyphenyl)methyl]imidazole?
The InChIKey is RJDZAWKSEGPSMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-21-16-7-3-14(4-8-16)18(20-12-11-19-13-20)15-5-9-17(22-2)10-6-15/h3-13,18H,1-2H3.
What are the key properties of 1-[bis(4-methoxyphenyl)methyl]imidazole?
1-[bis(4-methoxyphenyl)methyl]imidazole has a molecular weight of 294.35 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[bis(4-methoxyphenyl)methyl]imidazole is sourced from PubChem (CID 10968400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).