1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole

C23H19FN2O — CID 167065399

IUPAC1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole
SMILESCc1ccc2c(oc3cc(F)ccc32)c1N1C=CN(c2ccccc2)C1C
InChIInChI=1S/C23H19FN2O/c1-15-8-10-20-19-11-9-17(24)14-21(19)27-23(20)22(15)26-13-12-25(16(26)2)18-6-4-3-5-7-18/h3-14,16H,1-2H3
InChIKeyLWRIJXZISGTDQR-UHFFFAOYSA-N
MW358.42 g/mol
LogP6.18
Rot. Bonds2

About 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole

1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole (PubChem CID 167065399) has the molecular formula C23H19FN2O and a molecular weight of 358.42 g/mol. Its IUPAC name is 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole.

Molecular Properties

Compound Name1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole
PubChem CID167065399
Molecular FormulaC23H19FN2O
Molecular Weight358.42 g/mol
Exact Mass358.15
IUPAC Name1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole
SMILESCc1ccc2c(oc3cc(F)ccc32)c1N1C=CN(c2ccccc2)C1C
InChIInChI=1S/C23H19FN2O/c1-15-8-10-20-19-11-9-17(24)14-21(19)27-23(20)22(15)26-13-12-25(16(26)2)18-6-4-3-5-7-18/h3-14,16H,1-2H3
InChIKeyLWRIJXZISGTDQR-UHFFFAOYSA-N
XLogP6.18
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.42
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole?
The IUPAC name of 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole (CID 167065399) is 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole.
What is the SMILES notation for 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole?
The canonical SMILES for 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole is Cc1ccc2c(oc3cc(F)ccc32)c1N1C=CN(c2ccccc2)C1C.
What is the InChIKey of 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole?
The InChIKey is LWRIJXZISGTDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN2O/c1-15-8-10-20-19-11-9-17(24)14-21(19)27-23(20)22(15)26-13-12-25(16(26)2)18-6-4-3-5-7-18/h3-14,16H,1-2H3.
What are the key properties of 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole?
1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole has a molecular weight of 358.42 g/mol, XLogP of 6.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-3-methyldibenzofuran-4-yl)-2-methyl-3-phenyl-2H-imidazole is sourced from PubChem (CID 167065399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).