2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide

C21H18N4O2 — CID 55951935

IUPAC2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide
SMILESCn1c(=O)n(CC(=O)Nc2ccc(-c3ccccc3)cn2)c2ccccc21
InChIInChI=1S/C21H18N4O2/c1-24-17-9-5-6-10-18(17)25(21(24)27)14-20(26)23-19-12-11-16(13-22-19)15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,22,23,26)
InChIKeyAZZGJESUFOZSFM-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.04
Rot. Bonds4

About 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide

2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide (PubChem CID 55951935) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide
PubChem CID55951935
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC Name2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide
SMILESCn1c(=O)n(CC(=O)Nc2ccc(-c3ccccc3)cn2)c2ccccc21
InChIInChI=1S/C21H18N4O2/c1-24-17-9-5-6-10-18(17)25(21(24)27)14-20(26)23-19-12-11-16(13-22-19)15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,22,23,26)
InChIKeyAZZGJESUFOZSFM-UHFFFAOYSA-N
XLogP3.04
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide (CID 55951935) is 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide is Cn1c(=O)n(CC(=O)Nc2ccc(-c3ccccc3)cn2)c2ccccc21.
What is the InChIKey of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide?
The InChIKey is AZZGJESUFOZSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c1-24-17-9-5-6-10-18(17)25(21(24)27)14-20(26)23-19-12-11-16(13-22-19)15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,22,23,26).
What are the key properties of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide?
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide has a molecular weight of 358.40 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5-phenyl-2-pyridinyl)acetamide is sourced from PubChem (CID 55951935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).