2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide

C16H18N2O2 — CID 62056347

IUPAC2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide
SMILESCc1cc(C)c(OCC(=O)Nc2ccccc2)c(N)c1
InChIInChI=1S/C16H18N2O2/c1-11-8-12(2)16(14(17)9-11)20-10-15(19)18-13-6-4-3-5-7-13/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyLROSSVHYDYSGIN-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.90
Rot. Bonds4

About 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide

2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide (PubChem CID 62056347) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide.

Molecular Properties

Compound Name2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide
PubChem CID62056347
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide
SMILESCc1cc(C)c(OCC(=O)Nc2ccccc2)c(N)c1
InChIInChI=1S/C16H18N2O2/c1-11-8-12(2)16(14(17)9-11)20-10-15(19)18-13-6-4-3-5-7-13/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyLROSSVHYDYSGIN-UHFFFAOYSA-N
XLogP2.90
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.90
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

2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide
CID 62056523
2-(2-amino-4,6-dimethylphenoxy)-N-ethylacetamide
CID 62057922
(2-anilino-2-oxoethyl) 2,4,6-trimethylbenzoate
CID 7472995
2-(4-cyano-2,6-dimethylphenoxy)-N-phenylacetamide
CID 65471325
N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 7913902
N-(4-methoxyphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 877304
N-[4-(dimethylamino)phenyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 112978164
3-[4-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]phenyl]propanoic acid
CID 119252301
2-(4-amino-2-fluoro-5-methylphenoxy)-N-phenylacetamide
CID 114415725
2-(3-hydroxy-5-methylphenoxy)-N-phenylacetamide
CID 107679862
2-(2-amino-4,6-dimethylphenoxy)-N-(2-methoxyethyl)acetamide
CID 62098346
N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 675140

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide?
The IUPAC name of 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide (CID 62056347) is 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide.
What is the SMILES notation for 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide?
The canonical SMILES for 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide is Cc1cc(C)c(OCC(=O)Nc2ccccc2)c(N)c1.
What is the InChIKey of 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide?
The InChIKey is LROSSVHYDYSGIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-8-12(2)16(14(17)9-11)20-10-15(19)18-13-6-4-3-5-7-13/h3-9H,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide?
2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide has a molecular weight of 270.33 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide is sourced from PubChem (CID 62056347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).