N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide

C24H19N3O3 — CID 78781674

IUPACN-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
SMILESCOc1ccc2c(CC(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)coc2c1
InChIInChI=1S/C24H19N3O3/c1-29-16-10-11-17-15(14-30-22(17)13-16)12-23(28)25-19-7-3-2-6-18(19)24-26-20-8-4-5-9-21(20)27-24/h2-11,13-14H,12H2,1H3,(H,25,28)(H,26,27)
InChIKeyZLGYMMHGOKQAJK-UHFFFAOYSA-N
MW397.43 g/mol
LogP5.17
Rot. Bonds5

About N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide

N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide (PubChem CID 78781674) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
PubChem CID78781674
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC NameN-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
SMILESCOc1ccc2c(CC(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)coc2c1
InChIInChI=1S/C24H19N3O3/c1-29-16-10-11-17-15(14-30-22(17)13-16)12-23(28)25-19-7-3-2-6-18(19)24-26-20-8-4-5-9-21(20)27-24/h2-11,13-14H,12H2,1H3,(H,25,28)(H,26,27)
InChIKeyZLGYMMHGOKQAJK-UHFFFAOYSA-N
XLogP5.17
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.43
LogP ≤ 55.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(6-methoxy-1H-benzimidazol-2-yl)phenyl]acetamide
CID 18984570
N-[2-(ethylaminomethyl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide;hydrochloride
CID 119439857
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 8011717
2-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]-N-propylbenzamide
CID 8750798
N-[2-(1H-benzimidazol-2-yl)phenyl]-3-methoxybenzamide
CID 742047
N-[2-(1H-benzimidazol-2-yl)phenyl]acetamide
CID 5137262
N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 94717593
N-benzyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 2598100
N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methylbutyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 9049656
N-(2,5-diethoxyphenyl)-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 26686594
2-(6-methoxy-1-benzofuran-3-yl)-N-(3-methylsulfanylphenyl)acetamide
CID 2665602
N-[2-(1H-benzimidazol-2-yl)phenyl]-4-(4-fluorophenoxy)butanamide
CID 78843524

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
The IUPAC name of N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide (CID 78781674) is N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide is COc1ccc2c(CC(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)coc2c1.
What is the InChIKey of N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
The InChIKey is ZLGYMMHGOKQAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c1-29-16-10-11-17-15(14-30-22(17)13-16)12-23(28)25-19-7-3-2-6-18(19)24-26-20-8-4-5-9-21(20)27-24/h2-11,13-14H,12H2,1H3,(H,25,28)(H,26,27).
What are the key properties of N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide has a molecular weight of 397.43 g/mol, XLogP of 5.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-benzimidazol-2-yl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 78781674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).