N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide

C19H22N2O4 — CID 134019141

IUPACN-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
SMILESCCOc1ccc(OCC(=O)Nc2cccc(NC(C)=O)c2C)cc1
InChIInChI=1S/C19H22N2O4/c1-4-24-15-8-10-16(11-9-15)25-12-19(23)21-18-7-5-6-17(13(18)2)20-14(3)22/h5-11H,4,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyBNQRURAGYUGGSH-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.37
Rot. Bonds7

About N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide

N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide (PubChem CID 134019141) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
PubChem CID134019141
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
SMILESCCOc1ccc(OCC(=O)Nc2cccc(NC(C)=O)c2C)cc1
InChIInChI=1S/C19H22N2O4/c1-4-24-15-8-10-16(11-9-15)25-12-19(23)21-18-7-5-6-17(13(18)2)20-14(3)22/h5-11H,4,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyBNQRURAGYUGGSH-UHFFFAOYSA-N
XLogP3.37
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamido-2-methylphenyl)-2-(4-cyanophenoxy)acetamide
CID 134019347
N-(3-acetamido-2-methylphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 134019332
N-(3-acetamido-2-methylphenyl)-2-(4-nitrophenoxy)acetamide
CID 134019200
N-(3-acetamido-2-methylphenyl)-4-(4-ethoxyphenyl)-4-oxobutanamide
CID 134019287
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300469
N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
CID 38300689
N-(2-aminophenyl)-2-(4-ethoxyphenoxy)acetamide
CID 16782338
N-(3-acetamido-2-methylphenyl)-2-(3-chloro-4-fluorophenoxy)acetamide
CID 38228993
N-(2-acetamidophenyl)-2-(4-chlorophenoxy)acetamide
CID 113093665
N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 759065
ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate
CID 87043151
2-cyano-N-[2-[[2-(4-ethoxyphenoxy)acetyl]amino]phenyl]acetamide
CID 108922952

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide?
The IUPAC name of N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide (CID 134019141) is N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide.
What is the SMILES notation for N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide?
The canonical SMILES for N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide is CCOc1ccc(OCC(=O)Nc2cccc(NC(C)=O)c2C)cc1.
What is the InChIKey of N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide?
The InChIKey is BNQRURAGYUGGSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-4-24-15-8-10-16(11-9-15)25-12-19(23)21-18-7-5-6-17(13(18)2)20-14(3)22/h5-11H,4,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide?
N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide has a molecular weight of 342.40 g/mol, XLogP of 3.37, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide is sourced from PubChem (CID 134019141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).