5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine

C18H21N3 — CID 79501213

IUPAC5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine
SMILESCc1ccc(C)c(C2(C)CN=C(N)N2c2ccccc2)c1
InChIInChI=1S/C18H21N3/c1-13-9-10-14(2)16(11-13)18(3)12-20-17(19)21(18)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H2,19,20)
InChIKeyBUPLGSPUJFSPEQ-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.35
Rot. Bonds2

About 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine

5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine (PubChem CID 79501213) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine
PubChem CID79501213
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine
SMILESCc1ccc(C)c(C2(C)CN=C(N)N2c2ccccc2)c1
InChIInChI=1S/C18H21N3/c1-13-9-10-14(2)16(11-13)18(3)12-20-17(19)21(18)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H2,19,20)
InChIKeyBUPLGSPUJFSPEQ-UHFFFAOYSA-N
XLogP3.35
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine?
The IUPAC name of 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine (CID 79501213) is 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine.
What is the SMILES notation for 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine?
The canonical SMILES for 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine is Cc1ccc(C)c(C2(C)CN=C(N)N2c2ccccc2)c1.
What is the InChIKey of 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine?
The InChIKey is BUPLGSPUJFSPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-13-9-10-14(2)16(11-13)18(3)12-20-17(19)21(18)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H2,19,20).
What are the key properties of 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine?
5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine has a molecular weight of 279.39 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylphenyl)-5-methyl-1-phenyl-4H-imidazol-2-amine is sourced from PubChem (CID 79501213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).