N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide

C17H17NO3 — CID 129038120

IUPACN-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(COc2ccccc2C(C)=O)cc1
InChIInChI=1S/C17H17NO3/c1-12(19)16-5-3-4-6-17(16)21-11-14-7-9-15(10-8-14)18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyPHEVMNMUCGWIHL-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.43
Rot. Bonds5

About N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide

N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide (PubChem CID 129038120) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide
PubChem CID129038120
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC NameN-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(COc2ccccc2C(C)=O)cc1
InChIInChI=1S/C17H17NO3/c1-12(19)16-5-3-4-6-17(16)21-11-14-7-9-15(10-8-14)18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyPHEVMNMUCGWIHL-UHFFFAOYSA-N
XLogP3.43
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[[4-[(2-acetylphenoxy)methyl]phenyl]methoxy]benzoate
CID 59575964
1-[2-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 2763955
methyl 4-[(2-acetylphenoxy)methyl]benzoate
CID 9172369
methyl 2-[[4-[(2-methoxycarbonylphenoxy)methyl]phenyl]methoxy]benzoate
CID 14323673
ethyl 4-[(2-acetylphenoxy)methyl]benzoate
CID 82312048
methyl 4-[(2-phenylmethoxybenzoyl)amino]benzoate
CID 4946351
1-[2-[[2-[(2-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
CID 13256788
[(2R)-1-(4-acetylanilino)-1-oxopropan-2-yl] 2-phenylmethoxybenzoate
CID 2605686
4-[(2-acetyl-4-fluorophenoxy)methyl]-N-phenylbenzamide
CID 112787692
2-[(4-fluorophenyl)methoxy]-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 55887151
2-(2-acetylphenoxy)-N-(4-phenyldiazenylphenyl)acetamide
CID 165365413
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide (CID 129038120) is N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide is CC(=O)Nc1ccc(COc2ccccc2C(C)=O)cc1.
What is the InChIKey of N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide?
The InChIKey is PHEVMNMUCGWIHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-12(19)16-5-3-4-6-17(16)21-11-14-7-9-15(10-8-14)18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20).
What are the key properties of N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide?
N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide has a molecular weight of 283.33 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-acetylphenoxy)methyl]phenyl]acetamide is sourced from PubChem (CID 129038120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).