N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide

C23H22N2O5 — CID 17231339

IUPACN-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
SMILESCOc1ccc(OCC(=O)Nc2cccc(NC(=O)COc3ccccc3)c2)cc1
InChIInChI=1S/C23H22N2O5/c1-28-19-10-12-21(13-11-19)30-16-23(27)25-18-7-5-6-17(14-18)24-22(26)15-29-20-8-3-2-4-9-20/h2-14H,15-16H2,1H3,(H,24,26)(H,25,27)
InChIKeyCBEVHPKBLUEPQA-UHFFFAOYSA-N
MW406.44 g/mol
LogP3.73
Rot. Bonds9

About N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide

N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide (PubChem CID 17231339) has the molecular formula C23H22N2O5 and a molecular weight of 406.44 g/mol. Its IUPAC name is N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
PubChem CID17231339
Molecular FormulaC23H22N2O5
Molecular Weight406.44 g/mol
Exact Mass406.15
IUPAC NameN-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
SMILESCOc1ccc(OCC(=O)Nc2cccc(NC(=O)COc3ccccc3)c2)cc1
InChIInChI=1S/C23H22N2O5/c1-28-19-10-12-21(13-11-19)30-16-23(27)25-18-7-5-6-17(14-18)24-22(26)15-29-20-8-3-2-4-9-20/h2-14H,15-16H2,1H3,(H,24,26)(H,25,27)
InChIKeyCBEVHPKBLUEPQA-UHFFFAOYSA-N
XLogP3.73
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.44
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 833180
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-[3-[(2-bromoacetyl)amino]phenyl]-2-phenoxyacetamide
CID 46736695
2-[4-(aminomethyl)phenoxy]-N-(3-methoxyphenyl)acetamide
CID 16795321
2-(4-tert-butylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 710366
[2-(3-methoxyanilino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 2590569
N-(3-carbamothioylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 39158622
2-(4-methoxyphenoxy)-N-(3-nitrophenyl)acetamide
CID 690203
[3-[(2-phenoxyacetyl)amino]phenyl] acetate
CID 6472442
4-[2-(3-methoxyanilino)-2-oxoethoxy]-N-(2-phenoxyethyl)benzamide
CID 27758187
N-[4-[(4-methoxyphenyl)methylamino]phenyl]-2-phenoxyacetamide
CID 112982725

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide (CID 17231339) is N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide is COc1ccc(OCC(=O)Nc2cccc(NC(=O)COc3ccccc3)c2)cc1.
What is the InChIKey of N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide?
The InChIKey is CBEVHPKBLUEPQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O5/c1-28-19-10-12-21(13-11-19)30-16-23(27)25-18-7-5-6-17(14-18)24-22(26)15-29-20-8-3-2-4-9-20/h2-14H,15-16H2,1H3,(H,24,26)(H,25,27).
What are the key properties of N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide?
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide has a molecular weight of 406.44 g/mol, XLogP of 3.73, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 17231339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).