5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline

C20H18N2 — CID 58517975

IUPAC5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline
SMILESCc1cc(C)c(-c2cc3ccccc3c3nccn23)c(C)c1
InChIInChI=1S/C20H18N2/c1-13-10-14(2)19(15(3)11-13)18-12-16-6-4-5-7-17(16)20-21-8-9-22(18)20/h4-12H,1-3H3
InChIKeyYAIMRSASJMNDOF-UHFFFAOYSA-N
MW286.38 g/mol
LogP5.08
Rot. Bonds1

About 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline

5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline (PubChem CID 58517975) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline.

Molecular Properties

Compound Name5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline
PubChem CID58517975
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC Name5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline
SMILESCc1cc(C)c(-c2cc3ccccc3c3nccn23)c(C)c1
InChIInChI=1S/C20H18N2/c1-13-10-14(2)19(15(3)11-13)18-12-16-6-4-5-7-17(16)20-21-8-9-22(18)20/h4-12H,1-3H3
InChIKeyYAIMRSASJMNDOF-UHFFFAOYSA-N
XLogP5.08
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.38
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,10-dimethyl-6-(2,4,6-trimethylphenyl)benzimidazolo[2,1-a]isoquinoline
CID 58517849
12,15-diazahexacyclo[15.8.0.02,11.04,9.012,16.019,24]pentacosa-1(25),2,4,6,8,10,13,15,17,19,21,23-dodecaene
CID 155769701
9-imidazo[1,2-f]phenanthridin-11-yloxy-3-(2,4,6-trimethylphenyl)-2,5,14-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 140950385
5,8-dimethylimidazo[1,2-f]phenanthridine
CID 58162818
11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine
CID 154611098
imidazo[1,2-f]phenanthridin-7-amine
CID 138528854
1,3-dimethylnaphthalene;ethane
CID 145447624
2,5,7-trimethylimidazo[1,2-f]phenanthridine
CID 59358884
2-(2,4,6-trimethylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617577
magnesium;5,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;iodide
CID 58162949
1-methyl-3-(4-methylnaphthalen-2-yl)naphthalene
CID 58049667
3-carbazol-9-yl-4-(2,4,6-trimethylphenyl)-2,5,11,17-tetrazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 176776052

Frequently Asked Questions

What is the IUPAC name of 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline?
The IUPAC name of 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline (CID 58517975) is 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline.
What is the SMILES notation for 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline?
The canonical SMILES for 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline is Cc1cc(C)c(-c2cc3ccccc3c3nccn23)c(C)c1.
What is the InChIKey of 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline?
The InChIKey is YAIMRSASJMNDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2/c1-13-10-14(2)19(15(3)11-13)18-12-16-6-4-5-7-17(16)20-21-8-9-22(18)20/h4-12H,1-3H3.
What are the key properties of 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline?
5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline has a molecular weight of 286.38 g/mol, XLogP of 5.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline is sourced from PubChem (CID 58517975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).