2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide

C20H20N4O — CID 15225718

IUPAC2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide
SMILESCNC(=O)Cc1c(-c2ccccc2)nc2n(C)c3ccc(C)cc3n12
InChIInChI=1S/C20H20N4O/c1-13-9-10-15-16(11-13)24-17(12-18(25)21-2)19(22-20(24)23(15)3)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3,(H,21,25)
InChIKeyPSICPVFKWWTUDL-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.09
Rot. Bonds3

About 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide

2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide (PubChem CID 15225718) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide
PubChem CID15225718
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC Name2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide
SMILESCNC(=O)Cc1c(-c2ccccc2)nc2n(C)c3ccc(C)cc3n12
InChIInChI=1S/C20H20N4O/c1-13-9-10-15-16(11-13)24-17(12-18(25)21-2)19(22-20(24)23(15)3)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3,(H,21,25)
InChIKeyPSICPVFKWWTUDL-UHFFFAOYSA-N
XLogP3.09
TPSA51.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide?
The IUPAC name of 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide (CID 15225718) is 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide.
What is the SMILES notation for 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide?
The canonical SMILES for 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide is CNC(=O)Cc1c(-c2ccccc2)nc2n(C)c3ccc(C)cc3n12.
What is the InChIKey of 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide?
The InChIKey is PSICPVFKWWTUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-13-9-10-15-16(11-13)24-17(12-18(25)21-2)19(22-20(24)23(15)3)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3,(H,21,25).
What are the key properties of 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide?
2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide has a molecular weight of 332.41 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,7-dimethyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-N-methylacetamide is sourced from PubChem (CID 15225718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).