N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide

C17H20N2O2 — CID 28867346

IUPACN-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
SMILESCc1ccc(NC(=O)COc2cccc(C)c2C)cc1N
InChIInChI=1S/C17H20N2O2/c1-11-5-4-6-16(13(11)3)21-10-17(20)19-14-8-7-12(2)15(18)9-14/h4-9H,10,18H2,1-3H3,(H,19,20)
InChIKeyXUDJQCTWRQFOHN-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.21
Rot. Bonds4

About N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide

N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide (PubChem CID 28867346) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
PubChem CID28867346
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
SMILESCc1ccc(NC(=O)COc2cccc(C)c2C)cc1N
InChIInChI=1S/C17H20N2O2/c1-11-5-4-6-16(13(11)3)21-10-17(20)19-14-8-7-12(2)15(18)9-14/h4-9H,10,18H2,1-3H3,(H,19,20)
InChIKeyXUDJQCTWRQFOHN-UHFFFAOYSA-N
XLogP3.21
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[5-[[2-(2,3-dimethylphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 46761130
N-(3-amino-4-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 43376403
3-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoic acid
CID 720618
5-[[2-(2,3-dimethylphenoxy)acetyl]amino]-2-hydroxybenzoic acid
CID 28675962
2-(2,3-dimethylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 720608
4-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoic acid
CID 19172685
2-(2,3-dimethylphenoxy)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18164294
N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867332
methyl 4-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoate
CID 720624
N-[3-[[2-(2,3-dimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 1334409
2-(2,3-dimethylphenoxy)-N-(3-propoxyphenyl)acetamide
CID 17097883
N-(3-amino-4-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 28867302

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide (CID 28867346) is N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide is Cc1ccc(NC(=O)COc2cccc(C)c2C)cc1N.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide?
The InChIKey is XUDJQCTWRQFOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11-5-4-6-16(13(11)3)21-10-17(20)19-14-8-7-12(2)15(18)9-14/h4-9H,10,18H2,1-3H3,(H,19,20).
What are the key properties of N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide?
N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide has a molecular weight of 284.36 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide is sourced from PubChem (CID 28867346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).