2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide

C24H25NO4 — CID 17123518

IUPAC2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
SMILESCc1ccc(C)c(OCC(=O)Nc2cccc(OCCOc3ccccc3)c2)c1
InChIInChI=1S/C24H25NO4/c1-18-11-12-19(2)23(15-18)29-17-24(26)25-20-7-6-10-22(16-20)28-14-13-27-21-8-4-3-5-9-21/h3-12,15-16H,13-14,17H2,1-2H3,(H,25,26)
InChIKeyZLLZXEFTIOATCC-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.78
Rot. Bonds9

About 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide

2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide (PubChem CID 17123518) has the molecular formula C24H25NO4 and a molecular weight of 391.47 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
PubChem CID17123518
Molecular FormulaC24H25NO4
Molecular Weight391.47 g/mol
Exact Mass391.18
IUPAC Name2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
SMILESCc1ccc(C)c(OCC(=O)Nc2cccc(OCCOc3ccccc3)c2)c1
InChIInChI=1S/C24H25NO4/c1-18-11-12-19(2)23(15-18)29-17-24(26)25-20-7-6-10-22(16-20)28-14-13-27-21-8-4-3-5-9-21/h3-12,15-16H,13-14,17H2,1-2H3,(H,25,26)
InChIKeyZLLZXEFTIOATCC-UHFFFAOYSA-N
XLogP4.78
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2,5-dimethylphenoxy)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 17079566
N-[3-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188255
N-(3-bromophenyl)-2-(2,5-dimethylphenoxy)acetamide
CID 17252160
2-(2-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 747103
N-(3-heptoxyphenyl)-2-(2-methylphenoxy)acetamide
CID 17138095
2-[2-(3-methoxyanilino)-2-oxoethoxy]-4-methylbenzoic acid
CID 45418378
3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide
CID 26914656
2-(4-methylanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54813929
N-[3-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231324
3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 26164583
2-(2-bromo-4-methylphenoxy)-N-[3-(3-phenylpropoxy)phenyl]acetamide
CID 17133202
propyl 3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzoate
CID 19167371

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide?
The IUPAC name of 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide (CID 17123518) is 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide is Cc1ccc(C)c(OCC(=O)Nc2cccc(OCCOc3ccccc3)c2)c1.
What is the InChIKey of 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide?
The InChIKey is ZLLZXEFTIOATCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO4/c1-18-11-12-19(2)23(15-18)29-17-24(26)25-20-7-6-10-22(16-20)28-14-13-27-21-8-4-3-5-9-21/h3-12,15-16H,13-14,17H2,1-2H3,(H,25,26).
What are the key properties of 2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide?
2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide has a molecular weight of 391.47 g/mol, XLogP of 4.78, 9 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-[3-(2-phenoxyethoxy)phenyl]acetamide is sourced from PubChem (CID 17123518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).