N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide

C24H20N4O2 — CID 50755549

IUPACN-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2c(-c3ccccc3)cn3c4ccccc4nc23)cc1
InChIInChI=1S/C24H20N4O2/c1-30-19-13-11-18(12-14-19)25-23(29)16-28-22(17-7-3-2-4-8-17)15-27-21-10-6-5-9-20(21)26-24(27)28/h2-15H,16H2,1H3,(H,25,29)
InChIKeyNLRPDMDLPFLLFU-UHFFFAOYSA-N
MW396.45 g/mol
LogP4.60
Rot. Bonds5

About N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide

N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide (PubChem CID 50755549) has the molecular formula C24H20N4O2 and a molecular weight of 396.45 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide
PubChem CID50755549
Molecular FormulaC24H20N4O2
Molecular Weight396.45 g/mol
Exact Mass396.16
IUPAC NameN-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2c(-c3ccccc3)cn3c4ccccc4nc23)cc1
InChIInChI=1S/C24H20N4O2/c1-30-19-13-11-18(12-14-19)25-23(29)16-28-22(17-7-3-2-4-8-17)15-27-21-10-6-5-9-20(21)26-24(27)28/h2-15H,16H2,1H3,(H,25,29)
InChIKeyNLRPDMDLPFLLFU-UHFFFAOYSA-N
XLogP4.60
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.45
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide (CID 50755549) is N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide is COc1ccc(NC(=O)Cn2c(-c3ccccc3)cn3c4ccccc4nc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide?
The InChIKey is NLRPDMDLPFLLFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O2/c1-30-19-13-11-18(12-14-19)25-23(29)16-28-22(17-7-3-2-4-8-17)15-27-21-10-6-5-9-20(21)26-24(27)28/h2-15H,16H2,1H3,(H,25,29).
What are the key properties of N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide?
N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide has a molecular weight of 396.45 g/mol, XLogP of 4.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(2-phenylimidazo[1,2-a]benzimidazol-3-yl)acetamide is sourced from PubChem (CID 50755549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).