4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole

C19H20N2O3 — CID 56943345

IUPAC4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole
SMILESCOc1ccc(-c2c(-c3cc(OC)cc(OC)c3)ncn2C)cc1
InChIInChI=1S/C19H20N2O3/c1-21-12-20-18(14-9-16(23-3)11-17(10-14)24-4)19(21)13-5-7-15(22-2)8-6-13/h5-12H,1-4H3
InChIKeyXMTDJFYQJONQEO-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.78
Rot. Bonds5

About 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole

4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole (PubChem CID 56943345) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole.

Molecular Properties

Compound Name4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole
PubChem CID56943345
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole
SMILESCOc1ccc(-c2c(-c3cc(OC)cc(OC)c3)ncn2C)cc1
InChIInChI=1S/C19H20N2O3/c1-21-12-20-18(14-9-16(23-3)11-17(10-14)24-4)19(21)13-5-7-15(22-2)8-6-13/h5-12H,1-4H3
InChIKeyXMTDJFYQJONQEO-UHFFFAOYSA-N
XLogP3.78
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole?
The IUPAC name of 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole (CID 56943345) is 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole.
What is the SMILES notation for 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole?
The canonical SMILES for 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole is COc1ccc(-c2c(-c3cc(OC)cc(OC)c3)ncn2C)cc1.
What is the InChIKey of 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole?
The InChIKey is XMTDJFYQJONQEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-21-12-20-18(14-9-16(23-3)11-17(10-14)24-4)19(21)13-5-7-15(22-2)8-6-13/h5-12H,1-4H3.
What are the key properties of 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole?
4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole has a molecular weight of 324.38 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxyphenyl)-5-(4-methoxyphenyl)-1-methylimidazole is sourced from PubChem (CID 56943345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).