2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole

C18H16N2O2 — CID 22083539

IUPAC2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole
SMILESCOc1ccc(-c2ccc3oc(C4=NCCN4)cc3c2)cc1
InChIInChI=1S/C18H16N2O2/c1-21-15-5-2-12(3-6-15)13-4-7-16-14(10-13)11-17(22-16)18-19-8-9-20-18/h2-7,10-11H,8-9H2,1H3,(H,19,20)
InChIKeyBPCNBMMCGNYGMA-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.46
Rot. Bonds3

About 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole

2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole (PubChem CID 22083539) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole
PubChem CID22083539
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole
SMILESCOc1ccc(-c2ccc3oc(C4=NCCN4)cc3c2)cc1
InChIInChI=1S/C18H16N2O2/c1-21-15-5-2-12(3-6-15)13-4-7-16-14(10-13)11-17(22-16)18-19-8-9-20-18/h2-7,10-11H,8-9H2,1H3,(H,19,20)
InChIKeyBPCNBMMCGNYGMA-UHFFFAOYSA-N
XLogP3.46
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole (CID 22083539) is 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole is COc1ccc(-c2ccc3oc(C4=NCCN4)cc3c2)cc1.
What is the InChIKey of 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole?
The InChIKey is BPCNBMMCGNYGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-21-15-5-2-12(3-6-15)13-4-7-16-14(10-13)11-17(22-16)18-19-8-9-20-18/h2-7,10-11H,8-9H2,1H3,(H,19,20).
What are the key properties of 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole?
2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole has a molecular weight of 292.34 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 22083539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).