N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide

C20H17N3O2S — CID 17033366

IUPACN-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide
SMILESCOc1cccc(NC(=O)Cn2c(-c3cccs3)nc3ccccc32)c1
InChIInChI=1S/C20H17N3O2S/c1-25-15-7-4-6-14(12-15)21-19(24)13-23-17-9-3-2-8-16(17)22-20(23)18-10-5-11-26-18/h2-12H,13H2,1H3,(H,21,24)
InChIKeyCHYWXDZKKXZNHY-UHFFFAOYSA-N
MW363.44 g/mol
LogP4.41
Rot. Bonds5

About N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide

N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide (PubChem CID 17033366) has the molecular formula C20H17N3O2S and a molecular weight of 363.44 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide
PubChem CID17033366
Molecular FormulaC20H17N3O2S
Molecular Weight363.44 g/mol
Exact Mass363.10
IUPAC NameN-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide
SMILESCOc1cccc(NC(=O)Cn2c(-c3cccs3)nc3ccccc32)c1
InChIInChI=1S/C20H17N3O2S/c1-25-15-7-4-6-14(12-15)21-19(24)13-23-17-9-3-2-8-16(17)22-20(23)18-10-5-11-26-18/h2-12H,13H2,1H3,(H,21,24)
InChIKeyCHYWXDZKKXZNHY-UHFFFAOYSA-N
XLogP4.41
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methoxyphenyl)-2-[2-(4-methylphenyl)benzimidazol-1-yl]acetamide
CID 17033082
N-(3-methoxyphenyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 3597096
2-[2-[(2-methoxyphenoxy)methyl]benzimidazol-1-yl]-N-(3-methoxyphenyl)acetamide
CID 17031925
2-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]-N-(3-methoxyphenyl)acetamide
CID 17032167
N-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)benzimidazol-1-yl]acetamide
CID 17033040
N-(4-methoxyphenyl)-2-[2-(3-methylphenyl)benzimidazol-1-yl]acetamide
CID 17032844
5-(1-ethylbenzimidazol-2-yl)-N-(3-methoxyphenyl)thiophene-2-carboxamide
CID 4731849
N-(3,4-dimethylphenyl)-2-[2-(4-methoxyphenyl)benzimidazol-1-yl]acetamide
CID 17033048
2-(2,5-dimethylpyrrol-1-yl)-N-(3-methoxyphenyl)acetamide
CID 21383169
N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
CID 110680381
N-(3-propoxyphenyl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide
CID 38825215
2-(4-cyclopropyl-5-oxo-3-thiophen-2-yl-1,2,4-triazol-1-yl)-N-(3-methoxyphenyl)acetamide
CID 90542240

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide (CID 17033366) is N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide is COc1cccc(NC(=O)Cn2c(-c3cccs3)nc3ccccc32)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
The InChIKey is CHYWXDZKKXZNHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2S/c1-25-15-7-4-6-14(12-15)21-19(24)13-23-17-9-3-2-8-16(17)22-20(23)18-10-5-11-26-18/h2-12H,13H2,1H3,(H,21,24).
What are the key properties of N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide has a molecular weight of 363.44 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 17033366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).