2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide

C22H21NO3 — CID 172656583

IUPAC2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide
SMILESCN(C)C(=O)COc1ccc2ccc(-c3cccc4c3OCC4)cc2c1
InChIInChI=1S/C22H21NO3/c1-23(2)21(24)14-26-19-9-8-15-6-7-17(12-18(15)13-19)20-5-3-4-16-10-11-25-22(16)20/h3-9,12-13H,10-11,14H2,1-2H3
InChIKeyYCAUAILCECZEFZ-UHFFFAOYSA-N
MW347.41 g/mol
LogP3.91
Rot. Bonds4

About 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide

2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide (PubChem CID 172656583) has the molecular formula C22H21NO3 and a molecular weight of 347.41 g/mol. Its IUPAC name is 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide
PubChem CID172656583
Molecular FormulaC22H21NO3
Molecular Weight347.41 g/mol
Exact Mass347.15
IUPAC Name2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide
SMILESCN(C)C(=O)COc1ccc2ccc(-c3cccc4c3OCC4)cc2c1
InChIInChI=1S/C22H21NO3/c1-23(2)21(24)14-26-19-9-8-15-6-7-17(12-18(15)13-19)20-5-3-4-16-10-11-25-22(16)20/h3-9,12-13H,10-11,14H2,1-2H3
InChIKeyYCAUAILCECZEFZ-UHFFFAOYSA-N
XLogP3.91
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.41
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide
CID 175641671
4-(2,3-dihydro-1-benzofuran-7-yl)-2-fluorobenzoic acid
CID 114746359
2-[4-[(Z)-3-(2,3-dihydro-1,4-benzodioxin-5-yl)prop-2-enoyl]phenoxy]-N,N-dimethylacetamide
CID 94579763
N-[(E)-2,3-dihydroinden-1-ylideneamino]-2-naphthalen-2-yloxyacetamide
CID 46662511
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-2-naphthalen-2-yloxyacetamide
CID 26072019
ethane;7-phenyl-2,3-dihydro-1-benzofuran;propane
CID 143222384
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-naphthalen-2-yloxyacetamide
CID 968751
N-[[4-(2,3-dihydro-1-benzofuran-7-yl)-2-fluorophenyl]methyl]ethanamine
CID 114746535
3-[2-(dimethylamino)-2-oxoethoxy]benzoic acid
CID 16769869
N-[(E)-(8-methyl-2,3-dihydrochromen-4-ylidene)amino]-2-(3-methylphenoxy)acetamide
CID 90481723
N-methyl-N-(1-methylpiperidin-4-yl)-2-naphthalen-2-yloxyacetamide
CID 59421573
2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N,N-dimethylacetamide
CID 141231672

Frequently Asked Questions

What is the IUPAC name of 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide?
The IUPAC name of 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide (CID 172656583) is 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide.
What is the SMILES notation for 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide?
The canonical SMILES for 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide is CN(C)C(=O)COc1ccc2ccc(-c3cccc4c3OCC4)cc2c1.
What is the InChIKey of 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide?
The InChIKey is YCAUAILCECZEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c1-23(2)21(24)14-26-19-9-8-15-6-7-17(12-18(15)13-19)20-5-3-4-16-10-11-25-22(16)20/h3-9,12-13H,10-11,14H2,1-2H3.
What are the key properties of 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide?
2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide has a molecular weight of 347.41 g/mol, XLogP of 3.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-(2,3-dihydro-1-benzofuran-7-yl)naphthalen-2-yl]oxy-N,N-dimethylacetamide is sourced from PubChem (CID 172656583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).