4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole

C19H19N3 — CID 3603787

IUPAC4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole
SMILESCCn1c2cc(C)c(C)cc2n2cc(-c3ccccc3)nc12
InChIInChI=1S/C19H19N3/c1-4-21-17-10-13(2)14(3)11-18(17)22-12-16(20-19(21)22)15-8-6-5-7-9-15/h5-12H,4H2,1-3H3
InChIKeyAXXIUDIJECVSIT-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.59
Rot. Bonds2

About 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole

4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole (PubChem CID 3603787) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole.

Molecular Properties

Compound Name4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole
PubChem CID3603787
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC Name4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole
SMILESCCn1c2cc(C)c(C)cc2n2cc(-c3ccccc3)nc12
InChIInChI=1S/C19H19N3/c1-4-21-17-10-13(2)14(3)11-18(17)22-12-16(20-19(21)22)15-8-6-5-7-9-15/h5-12H,4H2,1-3H3
InChIKeyAXXIUDIJECVSIT-UHFFFAOYSA-N
XLogP4.59
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-4-propylimidazo[1,2-a]benzimidazole
CID 799630
diethyl-[2-(2-phenylimidazo[1,2-a]benzimidazol-4-yl)ethyl]azanium
CID 7358652
4-ethyl-2-methylimidazo[1,2-a]benzimidazole;hydrochloride
CID 2853813
2-(1,3-benzodioxol-5-yl)-4-ethylimidazo[1,2-a]benzimidazole;hydrochloride
CID 52994959
4-butyl-2-(4-fluorophenyl)imidazo[1,2-a]benzimidazole;hydrochloride
CID 52994899
2-(4-fluorophenyl)-4-[(4-methylphenyl)methyl]imidazo[1,2-a]benzimidazole
CID 3281057
2-(4-phenylphenyl)-4-(2-piperidin-1-ylethyl)imidazo[1,2-a]benzimidazole;dihydrochloride
CID 2858997
5-methyl-2-phenylimidazo[1,2-a]pyridine
CID 735395
2-[2-(3-bromophenyl)imidazo[1,2-a]benzimidazol-4-yl]-N,N-diethylethanamine
CID 3332849
3-methyl-6-phenyl-2-(2,4,6-trimethylphenyl)imidazo[2,1-b][1,3]thiazole
CID 139241032
2-(4-nitrophenyl)-4-propylimidazo[1,2-a]benzimidazole
CID 780051
2-[2-(4-chlorophenyl)imidazo[1,2-a]benzimidazol-4-yl]-N,N-diethylethanamine
CID 1097858

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole?
The IUPAC name of 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole (CID 3603787) is 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole.
What is the SMILES notation for 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole?
The canonical SMILES for 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole is CCn1c2cc(C)c(C)cc2n2cc(-c3ccccc3)nc12.
What is the InChIKey of 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole?
The InChIKey is AXXIUDIJECVSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-4-21-17-10-13(2)14(3)11-18(17)22-12-16(20-19(21)22)15-8-6-5-7-9-15/h5-12H,4H2,1-3H3.
What are the key properties of 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole?
4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole has a molecular weight of 289.38 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazole is sourced from PubChem (CID 3603787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).