1,3-bis(4-methoxyphenyl)-2H-imidazole

C17H18N2O2 — CID 151621895

IUPAC1,3-bis(4-methoxyphenyl)-2H-imidazole
SMILESCOc1ccc(N2C=CN(c3ccc(OC)cc3)C2)cc1
InChIInChI=1S/C17H18N2O2/c1-20-16-7-3-14(4-8-16)18-11-12-19(13-18)15-5-9-17(21-2)10-6-15/h3-12H,13H2,1-2H3
InChIKeyQORNEMHVIHIHOK-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.46
Rot. Bonds4

About 1,3-bis(4-methoxyphenyl)-2H-imidazole

1,3-bis(4-methoxyphenyl)-2H-imidazole (PubChem CID 151621895) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 1,3-bis(4-methoxyphenyl)-2H-imidazole.

Molecular Properties

Compound Name1,3-bis(4-methoxyphenyl)-2H-imidazole
PubChem CID151621895
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name1,3-bis(4-methoxyphenyl)-2H-imidazole
SMILESCOc1ccc(N2C=CN(c3ccc(OC)cc3)C2)cc1
InChIInChI=1S/C17H18N2O2/c1-20-16-7-3-14(4-8-16)18-11-12-19(13-18)15-5-9-17(21-2)10-6-15/h3-12H,13H2,1-2H3
InChIKeyQORNEMHVIHIHOK-UHFFFAOYSA-N
XLogP3.46
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 11048737
1-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-4-carbonitrile
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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(4-methoxyphenyl)-2H-imidazole?
The IUPAC name of 1,3-bis(4-methoxyphenyl)-2H-imidazole (CID 151621895) is 1,3-bis(4-methoxyphenyl)-2H-imidazole.
What is the SMILES notation for 1,3-bis(4-methoxyphenyl)-2H-imidazole?
The canonical SMILES for 1,3-bis(4-methoxyphenyl)-2H-imidazole is COc1ccc(N2C=CN(c3ccc(OC)cc3)C2)cc1.
What is the InChIKey of 1,3-bis(4-methoxyphenyl)-2H-imidazole?
The InChIKey is QORNEMHVIHIHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-20-16-7-3-14(4-8-16)18-11-12-19(13-18)15-5-9-17(21-2)10-6-15/h3-12H,13H2,1-2H3.
What are the key properties of 1,3-bis(4-methoxyphenyl)-2H-imidazole?
1,3-bis(4-methoxyphenyl)-2H-imidazole has a molecular weight of 282.34 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(4-methoxyphenyl)-2H-imidazole is sourced from PubChem (CID 151621895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).