1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole

C22H26N2 — CID 71028638

IUPAC1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole
SMILESCc1cc(-c2ncn(C)c2-c2ccc(C)c(C)c2C)cc(C)c1C
InChIInChI=1S/C22H26N2/c1-13-8-9-20(18(6)17(13)5)22-21(23-12-24(22)7)19-10-14(2)16(4)15(3)11-19/h8-12H,1-7H3
InChIKeyPOEDQOYUODBDOL-UHFFFAOYSA-N
MW318.46 g/mol
LogP5.60
Rot. Bonds2

About 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole

1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole (PubChem CID 71028638) has the molecular formula C22H26N2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole.

Molecular Properties

Compound Name1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole
PubChem CID71028638
Molecular FormulaC22H26N2
Molecular Weight318.46 g/mol
Exact Mass318.21
IUPAC Name1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole
SMILESCc1cc(-c2ncn(C)c2-c2ccc(C)c(C)c2C)cc(C)c1C
InChIInChI=1S/C22H26N2/c1-13-8-9-20(18(6)17(13)5)22-21(23-12-24(22)7)19-10-14(2)16(4)15(3)11-19/h8-12H,1-7H3
InChIKeyPOEDQOYUODBDOL-UHFFFAOYSA-N
XLogP5.60
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.46
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole?
The IUPAC name of 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole (CID 71028638) is 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole.
What is the SMILES notation for 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole?
The canonical SMILES for 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole is Cc1cc(-c2ncn(C)c2-c2ccc(C)c(C)c2C)cc(C)c1C.
What is the InChIKey of 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole?
The InChIKey is POEDQOYUODBDOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2/c1-13-8-9-20(18(6)17(13)5)22-21(23-12-24(22)7)19-10-14(2)16(4)15(3)11-19/h8-12H,1-7H3.
What are the key properties of 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole?
1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole has a molecular weight of 318.46 g/mol, XLogP of 5.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(2,3,4-trimethylphenyl)-4-(3,4,5-trimethylphenyl)imidazole is sourced from PubChem (CID 71028638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).