1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole

C21H26N2 — CID 175120549

IUPAC1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole
SMILESCc1ccc(C(C)C)c(C2=CN(C)C(c3ccccc3)N2C)c1
InChIInChI=1S/C21H26N2/c1-15(2)18-12-11-16(3)13-19(18)20-14-22(4)21(23(20)5)17-9-7-6-8-10-17/h6-15,21H,1-5H3
InChIKeyWINDWXXDTGLXAR-UHFFFAOYSA-N
MW306.45 g/mol
LogP4.99
Rot. Bonds3

About 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole

1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole (PubChem CID 175120549) has the molecular formula C21H26N2 and a molecular weight of 306.45 g/mol. Its IUPAC name is 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole.

Molecular Properties

Compound Name1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole
PubChem CID175120549
Molecular FormulaC21H26N2
Molecular Weight306.45 g/mol
Exact Mass306.21
IUPAC Name1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole
SMILESCc1ccc(C(C)C)c(C2=CN(C)C(c3ccccc3)N2C)c1
InChIInChI=1S/C21H26N2/c1-15(2)18-12-11-16(3)13-19(18)20-14-22(4)21(23(20)5)17-9-7-6-8-10-17/h6-15,21H,1-5H3
InChIKeyWINDWXXDTGLXAR-UHFFFAOYSA-N
XLogP4.99
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-chloro-4-methyl-2-(5-methyl-2-propan-2-ylphenyl)benzene
CID 91389922
2-(4-methylphenyl)-4-phenyl-1-propan-2-ylbenzene
CID 163504482
ethane;5-methyl-2-propan-2-ylaniline
CID 142850696
(5-methyl-2-propan-2-ylphenyl)-phenylmethanone
CID 617254
4-methyl-1-(4-methyl-2-propan-2-ylphenyl)-2-propan-2-ylbenzene
CID 20697925
4-methyl-2-phenyl-1-(1-phenylethyl)benzene
CID 123164572
2-(4-fluoro-2-methylphenyl)-4-methyl-1-propan-2-ylbenzene
CID 123460717
cumene;ethane;methane;1-methyl-3-propan-2-ylbenzene;1-methyl-4-propan-2-ylbenzene
CID 158230209
1-methyl-3-propan-2-ylbenzene;molecular hydrogen;toluene
CID 170971912
1-(2,5-dimethylphenyl)ethyl-triphenylphosphanium bromide
CID 87629552
1-benzyl-4-methyl-2-propan-2-ylbenzene
CID 59400391
4-methyl-1-phenoxy-2-propan-2-ylbenzene
CID 54452186

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole?
The IUPAC name of 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole (CID 175120549) is 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole.
What is the SMILES notation for 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole?
The canonical SMILES for 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole is Cc1ccc(C(C)C)c(C2=CN(C)C(c3ccccc3)N2C)c1.
What is the InChIKey of 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole?
The InChIKey is WINDWXXDTGLXAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2/c1-15(2)18-12-11-16(3)13-19(18)20-14-22(4)21(23(20)5)17-9-7-6-8-10-17/h6-15,21H,1-5H3.
What are the key properties of 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole?
1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole has a molecular weight of 306.45 g/mol, XLogP of 4.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-(5-methyl-2-propan-2-ylphenyl)-2-phenyl-2H-imidazole is sourced from PubChem (CID 175120549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).