2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide

C23H21NO4 — CID 2911367

IUPAC2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
SMILESCOc1cc2c(cc1NC(=O)COc1cc(C)ccc1C)oc1ccccc12
InChIInChI=1S/C23H21NO4/c1-14-8-9-15(2)20(10-14)27-13-23(25)24-18-12-21-17(11-22(18)26-3)16-6-4-5-7-19(16)28-21/h4-12H,13H2,1-3H3,(H,24,25)
InChIKeyWLRKKCVLGNOBHA-UHFFFAOYSA-N
MW375.42 g/mol
LogP5.23
Rot. Bonds5

About 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide

2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide (PubChem CID 2911367) has the molecular formula C23H21NO4 and a molecular weight of 375.42 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
PubChem CID2911367
Molecular FormulaC23H21NO4
Molecular Weight375.42 g/mol
Exact Mass375.15
IUPAC Name2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
SMILESCOc1cc2c(cc1NC(=O)COc1cc(C)ccc1C)oc1ccccc12
InChIInChI=1S/C23H21NO4/c1-14-8-9-15(2)20(10-14)27-13-23(25)24-18-12-21-17(11-22(18)26-3)16-6-4-5-7-19(16)28-21/h4-12H,13H2,1-3H3,(H,24,25)
InChIKeyWLRKKCVLGNOBHA-UHFFFAOYSA-N
XLogP5.23
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.42
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dichlorophenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
CID 2788847
N-(2-methoxydibenzofuran-3-yl)-2-(4-methylsulfanylphenoxy)acetamide
CID 7893725
2-(2,5-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 807483
N-(2-methoxydibenzofuran-3-yl)-2-[(Z)-(4-methylphenyl)methylideneamino]oxyacetamide
CID 7705451
methyl 2-[4-[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethoxy]phenyl]acetate
CID 7695279
[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl] 2-hydroxy-2-phenylacetate
CID 23911923
2-(2,5-dimethylphenoxy)-N-[2-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]acetamide
CID 1012654
N-(2-methoxydibenzofuran-3-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 55488412
[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl] cyclopropanecarboxylate
CID 2510908
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
CID 4022781
methyl 4-[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethoxy]-3-nitrobenzoate
CID 30122648
N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
CID 2935191

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
The IUPAC name of 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide (CID 2911367) is 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
The canonical SMILES for 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide is COc1cc2c(cc1NC(=O)COc1cc(C)ccc1C)oc1ccccc12.
What is the InChIKey of 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
The InChIKey is WLRKKCVLGNOBHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO4/c1-14-8-9-15(2)20(10-14)27-13-23(25)24-18-12-21-17(11-22(18)26-3)16-6-4-5-7-19(16)28-21/h4-12H,13H2,1-3H3,(H,24,25).
What are the key properties of 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide has a molecular weight of 375.42 g/mol, XLogP of 5.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)acetamide is sourced from PubChem (CID 2911367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).