N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide

C16H18N2O3 — CID 28867332

IUPACN-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide
SMILESCOc1cccc(OCC(=O)Nc2ccc(C)c(N)c2)c1
InChIInChI=1S/C16H18N2O3/c1-11-6-7-12(8-15(11)17)18-16(19)10-21-14-5-3-4-13(9-14)20-2/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyDSHNDMYPRKFKQS-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.60
Rot. Bonds5

About N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide

N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide (PubChem CID 28867332) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide
PubChem CID28867332
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide
SMILESCOc1cccc(OCC(=O)Nc2ccc(C)c(N)c2)c1
InChIInChI=1S/C16H18N2O3/c1-11-6-7-12(8-15(11)17)18-16(19)10-21-14-5-3-4-13(9-14)20-2/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyDSHNDMYPRKFKQS-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

N-(3-amino-4-ethylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867334
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-(3-amino-4-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 28867302
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
N-(3-amino-4-methylphenyl)-2-(3-fluoro-4-methylphenoxy)acetamide
CID 107168696
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809
N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 28867346
N-[(3,4-dimethylphenyl)carbamothioyl]-2-(3-methoxyphenoxy)acetamide
CID 3877671
2-(3-methoxyphenoxy)-N-(4-sulfamoylphenyl)acetamide
CID 19204089
methyl 2-chloro-5-[[2-(3-methoxyphenoxy)acetyl]amino]benzoate
CID 94600273
N-(3-methoxyphenyl)-2-(2,3,6-trimethylphenoxy)acetamide
CID 731174
N-(2-amino-4,5-dimethoxyphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867331

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide (CID 28867332) is N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide is COc1cccc(OCC(=O)Nc2ccc(C)c(N)c2)c1.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide?
The InChIKey is DSHNDMYPRKFKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-6-7-12(8-15(11)17)18-16(19)10-21-14-5-3-4-13(9-14)20-2/h3-9H,10,17H2,1-2H3,(H,18,19).
What are the key properties of N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide?
N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)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 N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide is sourced from PubChem (CID 28867332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).