N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide

C20H17N3OS — CID 19242930

IUPACN-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(Cc2cccs2)nc2ccccc21)Nc1ccccc1
InChIInChI=1S/C20H17N3OS/c24-20(21-15-7-2-1-3-8-15)14-23-18-11-5-4-10-17(18)22-19(23)13-16-9-6-12-25-16/h1-12H,13-14H2,(H,21,24)
InChIKeyAURQZLNIBZRHST-UHFFFAOYSA-N
MW347.44 g/mol
LogP4.33
Rot. Bonds5

About N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide

N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide (PubChem CID 19242930) has the molecular formula C20H17N3OS and a molecular weight of 347.44 g/mol. Its IUPAC name is N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide
PubChem CID19242930
Molecular FormulaC20H17N3OS
Molecular Weight347.44 g/mol
Exact Mass347.11
IUPAC NameN-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(Cc2cccs2)nc2ccccc21)Nc1ccccc1
InChIInChI=1S/C20H17N3OS/c24-20(21-15-7-2-1-3-8-15)14-23-18-11-5-4-10-17(18)22-19(23)13-16-9-6-12-25-16/h1-12H,13-14H2,(H,21,24)
InChIKeyAURQZLNIBZRHST-UHFFFAOYSA-N
XLogP4.33
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]-N-methylacetamide
CID 1153553
1-(4-chlorophenyl)-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]ethanone
CID 19243714
2-(2-benzylbenzimidazol-1-yl)-N-(4-fluorophenyl)acetamide
CID 17032358
2-[2-(2-phenylethyl)benzimidazol-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 17031686
2-(2-aminobenzimidazol-1-yl)-N-phenylacetamide
CID 82358872
N-(4-anilinophenyl)-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetamide
CID 55457213
4-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]butan-1-amine
CID 82144723
1-(3-phenylpropyl)-2-(thiophen-2-ylmethyl)benzimidazole
CID 19243007
N-[2-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]ethyl]butanamide
CID 17030370
2-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]-N-phenylacetamide
CID 17032157
3-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]propan-1-amine
CID 82144722
2-[2-(2-anilino-2-oxoethyl)sulfanylbenzimidazol-1-yl]-N-phenylacetamide
CID 21177802

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide (CID 19242930) is N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide is O=C(Cn1c(Cc2cccs2)nc2ccccc21)Nc1ccccc1.
What is the InChIKey of N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide?
The InChIKey is AURQZLNIBZRHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3OS/c24-20(21-15-7-2-1-3-8-15)14-23-18-11-5-4-10-17(18)22-19(23)13-16-9-6-12-25-16/h1-12H,13-14H2,(H,21,24).
What are the key properties of N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide?
N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide has a molecular weight of 347.44 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-[2-(thiophen-2-ylmethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 19242930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).