N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide

C17H18N2O3 — CID 683793

IUPACN-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)COc2ccccc2C)c1
InChIInChI=1S/C17H18N2O3/c1-12-6-3-4-9-16(12)22-11-17(21)19-15-8-5-7-14(10-15)18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyJLTOEMICEKLSFN-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.97
Rot. Bonds5

About N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide

N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide (PubChem CID 683793) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide
PubChem CID683793
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)COc2ccccc2C)c1
InChIInChI=1S/C17H18N2O3/c1-12-6-3-4-9-16(12)22-11-17(21)19-15-8-5-7-14(10-15)18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyJLTOEMICEKLSFN-UHFFFAOYSA-N
XLogP2.97
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide (CID 683793) is N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide is CC(=O)Nc1cccc(NC(=O)COc2ccccc2C)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide?
The InChIKey is JLTOEMICEKLSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-6-3-4-9-16(12)22-11-17(21)19-15-8-5-7-14(10-15)18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide?
N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide has a molecular weight of 298.34 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 683793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).