2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide

C18H19NO4 — CID 33099560

IUPAC2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide
SMILESCOCc1cccc(NC(=O)COc2cccc(C(C)=O)c2)c1
InChIInChI=1S/C18H19NO4/c1-13(20)15-6-4-8-17(10-15)23-12-18(21)19-16-7-3-5-14(9-16)11-22-2/h3-10H,11-12H2,1-2H3,(H,19,21)
InChIKeyOUBBZFXQROJRSK-UHFFFAOYSA-N
MW313.35 g/mol
LogP3.05
Rot. Bonds7

About 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide

2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide (PubChem CID 33099560) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide
PubChem CID33099560
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC Name2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide
SMILESCOCc1cccc(NC(=O)COc2cccc(C(C)=O)c2)c1
InChIInChI=1S/C18H19NO4/c1-13(20)15-6-4-8-17(10-15)23-12-18(21)19-16-7-3-5-14(9-16)11-22-2/h3-10H,11-12H2,1-2H3,(H,19,21)
InChIKeyOUBBZFXQROJRSK-UHFFFAOYSA-N
XLogP3.05
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
CID 2627260
2-(3-acetylphenoxy)-N-(4-methylphenyl)acetamide
CID 2616941
2-[4-[[2-(3-acetylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35365218
N-[3-[[2-(3-acetylphenoxy)acetyl]amino]phenyl]pyridine-4-carboxamide
CID 39187397
N-(3-acetylphenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19175983
2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2710573
2-(3-acetylphenoxy)-N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]acetamide
CID 55647563
2-(3-acetylphenoxy)-N-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 2639907
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
2-(3-acetylphenoxy)-N-pyridin-2-ylacetamide
CID 82312002
N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide
CID 86982965
N-[3-(aminomethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 16783753

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide?
The IUPAC name of 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide (CID 33099560) is 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide.
What is the SMILES notation for 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide?
The canonical SMILES for 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide is COCc1cccc(NC(=O)COc2cccc(C(C)=O)c2)c1.
What is the InChIKey of 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide?
The InChIKey is OUBBZFXQROJRSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO4/c1-13(20)15-6-4-8-17(10-15)23-12-18(21)19-16-7-3-5-14(9-16)11-22-2/h3-10H,11-12H2,1-2H3,(H,19,21).
What are the key properties of 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide?
2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide has a molecular weight of 313.35 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide is sourced from PubChem (CID 33099560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).