1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole

C20H20N4O2 — CID 154820768

IUPAC1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole
SMILESCCn1cnc(Cn2ccnc2-c2ccc(-c3ccc(OC)cc3)o2)c1
InChIInChI=1S/C20H20N4O2/c1-3-23-12-16(22-14-23)13-24-11-10-21-20(24)19-9-8-18(26-19)15-4-6-17(25-2)7-5-15/h4-12,14H,3,13H2,1-2H3
InChIKeyBPORVWIGMVERIQ-UHFFFAOYSA-N
MW348.41 g/mol
LogP4.08
Rot. Bonds6

About 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole

1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole (PubChem CID 154820768) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole.

Molecular Properties

Compound Name1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole
PubChem CID154820768
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC Name1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole
SMILESCCn1cnc(Cn2ccnc2-c2ccc(-c3ccc(OC)cc3)o2)c1
InChIInChI=1S/C20H20N4O2/c1-3-23-12-16(22-14-23)13-24-11-10-21-20(24)19-9-8-18(26-19)15-4-6-17(25-2)7-5-15/h4-12,14H,3,13H2,1-2H3
InChIKeyBPORVWIGMVERIQ-UHFFFAOYSA-N
XLogP4.08
TPSA58.01 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

acetic acid;1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole
CID 163334431
4-[[2-(4-methoxyphenyl)imidazol-1-yl]methyl]pyrimidine
CID 56716138
3-[1-[(1-ethylimidazol-4-yl)methyl]imidazol-2-yl]imidazo[1,2-a]pyridine
CID 155492202
1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride
CID 3073611
3-[2-[5-[4-(trifluoromethoxy)phenyl]furan-2-yl]imidazol-1-yl]propan-1-ol
CID 166612472
2-(4-methoxyphenyl)-5-methylfuran
CID 11171456
1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole
CID 71548090
5-(4-methoxyphenyl)-3-[(2-methylimidazol-1-yl)methyl]pyridazine
CID 22240312
2-[4-[1-[(1-ethylpyrazol-4-yl)methyl]imidazol-2-yl]phenoxy]pyrimidine
CID 56870178
1-[2-(4-methoxyphenoxy)ethyl]-2-methylimidazole
CID 887351
2-[5-(2-bromophenyl)furan-2-yl]-1-ethylimidazole
CID 14798611
(1-ethylimidazol-2-yl)-(4-methoxyphenyl)diazene
CID 12984428

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole?
The IUPAC name of 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole (CID 154820768) is 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole.
What is the SMILES notation for 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole?
The canonical SMILES for 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole is CCn1cnc(Cn2ccnc2-c2ccc(-c3ccc(OC)cc3)o2)c1.
What is the InChIKey of 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole?
The InChIKey is BPORVWIGMVERIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-3-23-12-16(22-14-23)13-24-11-10-21-20(24)19-9-8-18(26-19)15-4-6-17(25-2)7-5-15/h4-12,14H,3,13H2,1-2H3.
What are the key properties of 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole?
1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole has a molecular weight of 348.41 g/mol, XLogP of 4.08, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole is sourced from PubChem (CID 154820768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).