2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide

C22H25N3O3 — CID 91821679

IUPAC2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide
SMILESCOCCn1c(C(C)NC(=O)Cc2ccc3c(c2)OCC3)nc2ccccc21
InChIInChI=1S/C22H25N3O3/c1-15(22-24-18-5-3-4-6-19(18)25(22)10-12-27-2)23-21(26)14-16-7-8-17-9-11-28-20(17)13-16/h3-8,13,15H,9-12,14H2,1-2H3,(H,23,26)
InChIKeyFFWJCHUXWMTPOH-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.04
Rot. Bonds7

About 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide

2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide (PubChem CID 91821679) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide
PubChem CID91821679
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide
SMILESCOCCn1c(C(C)NC(=O)Cc2ccc3c(c2)OCC3)nc2ccccc21
InChIInChI=1S/C22H25N3O3/c1-15(22-24-18-5-3-4-6-19(18)25(22)10-12-27-2)23-21(26)14-16-7-8-17-9-11-28-20(17)13-16/h3-8,13,15H,9-12,14H2,1-2H3,(H,23,26)
InChIKeyFFWJCHUXWMTPOH-UHFFFAOYSA-N
XLogP3.04
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide with MolForge

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Related Compounds

2-(2,3-dihydro-1-benzofuran-6-yl)-N-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]acetamide
CID 91823518
N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]-3-(4-methoxyphenyl)propanamide
CID 91821956
2-(3,4-dimethoxyphenyl)-N-[1-[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]ethyl]acetamide
CID 16972885
N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 16619750
N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]-2-phenoxyacetamide
CID 16971833
2-(3,4-dimethoxyphenyl)-N-[1-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]ethyl]acetamide
CID 16972884
2-(4-methoxyphenyl)-N-[1-(1-propylbenzimidazol-2-yl)ethyl]acetamide
CID 16972665
N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]-4-phenyloxane-4-carboxamide
CID 91821029
N-[(1S)-1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]-4-phenyloxane-4-carboxamide
CID 91640345
3-methoxy-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]benzamide
CID 17010214
N-[1-(1-butylbenzimidazol-2-yl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 16972671
2-(4-methoxyphenyl)-N-[1-(1-octadecylbenzimidazol-2-yl)ethyl]acetamide
CID 16972683

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide (CID 91821679) is 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide is COCCn1c(C(C)NC(=O)Cc2ccc3c(c2)OCC3)nc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide?
The InChIKey is FFWJCHUXWMTPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-15(22-24-18-5-3-4-6-19(18)25(22)10-12-27-2)23-21(26)14-16-7-8-17-9-11-28-20(17)13-16/h3-8,13,15H,9-12,14H2,1-2H3,(H,23,26).
What are the key properties of 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide?
2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide has a molecular weight of 379.46 g/mol, XLogP of 3.04, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-6-yl)-N-[1-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]acetamide is sourced from PubChem (CID 91821679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).