2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole

C25H21N3 — CID 3561010

IUPAC2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole
SMILESCCc1ccc(-c2cn3c(-c4ccccc4)c(-c4ccccc4)nc3[nH]2)cc1
InChIInChI=1S/C25H21N3/c1-2-18-13-15-19(16-14-18)22-17-28-24(21-11-7-4-8-12-21)23(27-25(28)26-22)20-9-5-3-6-10-20/h3-17H,2H2,1H3,(H,26,27)
InChIKeyAZFRNKBUBNFNRH-UHFFFAOYSA-N
MW363.46 g/mol
LogP6.23
Rot. Bonds4

About 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole

2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole (PubChem CID 3561010) has the molecular formula C25H21N3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole.

Molecular Properties

Compound Name2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole
PubChem CID3561010
Molecular FormulaC25H21N3
Molecular Weight363.46 g/mol
Exact Mass363.17
IUPAC Name2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole
SMILESCCc1ccc(-c2cn3c(-c4ccccc4)c(-c4ccccc4)nc3[nH]2)cc1
InChIInChI=1S/C25H21N3/c1-2-18-13-15-19(16-14-18)22-17-28-24(21-11-7-4-8-12-21)23(27-25(28)26-22)20-9-5-3-6-10-20/h3-17H,2H2,1H3,(H,26,27)
InChIKeyAZFRNKBUBNFNRH-UHFFFAOYSA-N
XLogP6.23
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 56.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[6-(4-ethylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367601
1-(4-ethylphenyl)-3,5-diphenylbenzene
CID 123998830
ethane;1-ethyl-4-phenylbenzene;methane
CID 142852812
acetylene;1-ethyl-4-phenylbenzene
CID 175126841
3-(4-ethylphenyl)-2-phenylquinoxalin-5-ol
CID 136657429
2-(4-fluorophenyl)-5,6-diphenyl-1-propylimidazo[1,2-a]imidazole
CID 4311842
2,4-dimethyl-7-(4-phenylphenyl)-6H-purino[7,8-a]imidazole-1,3-dione
CID 11545203
bicyclo[2.2.0]hexa-1,3,5-triene;ethylbenzene
CID 175075360
1-ethyl-4-(2-phenylphenyl)benzene;sulfane
CID 160558702
6-(4-ethylphenyl)-2-methyl-3-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198440
2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
2-(4-ethylphenyl)-N-methylquinazolin-4-amine
CID 63500302

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole?
The IUPAC name of 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole (CID 3561010) is 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole.
What is the SMILES notation for 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole?
The canonical SMILES for 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole is CCc1ccc(-c2cn3c(-c4ccccc4)c(-c4ccccc4)nc3[nH]2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole?
The InChIKey is AZFRNKBUBNFNRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3/c1-2-18-13-15-19(16-14-18)22-17-28-24(21-11-7-4-8-12-21)23(27-25(28)26-22)20-9-5-3-6-10-20/h3-17H,2H2,1H3,(H,26,27).
What are the key properties of 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole?
2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole has a molecular weight of 363.46 g/mol, XLogP of 6.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole is sourced from PubChem (CID 3561010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).