2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide

C16H18N2O3 — CID 43437876

IUPAC2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2cccc(N)c2C)cc1
InChIInChI=1S/C16H18N2O3/c1-11-14(17)4-3-5-15(11)21-10-16(19)18-12-6-8-13(20-2)9-7-12/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyUEWBGHAEHHGVDD-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.60
Rot. Bonds5

About 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide

2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide (PubChem CID 43437876) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide
PubChem CID43437876
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2cccc(N)c2C)cc1
InChIInChI=1S/C16H18N2O3/c1-11-14(17)4-3-5-15(11)21-10-16(19)18-12-6-8-13(20-2)9-7-12/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyUEWBGHAEHHGVDD-UHFFFAOYSA-N
XLogP2.60
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2,3-dimethylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 720608
2-(2-amino-3-methylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 43438063
N-(4-methoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 835733
2-(2,6-dimethylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 835384
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
methyl 2-(3-amino-2-methylphenoxy)acetate
CID 43437919
N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 28867346
3-amino-N-(4-methoxyphenyl)-2-methylbenzamide
CID 16787137
2-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)acetamide
CID 7707204
methyl 4-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoate
CID 720624
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
2-(2-aminophenoxy)-N-(4-fluorophenyl)acetamide
CID 16789642

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide (CID 43437876) is 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)COc2cccc(N)c2C)cc1.
What is the InChIKey of 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide?
The InChIKey is UEWBGHAEHHGVDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-14(17)4-3-5-15(11)21-10-16(19)18-12-6-8-13(20-2)9-7-12/h3-9H,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide?
2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 43437876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).