2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide

C17H19NO2 — CID 63102778

IUPAC2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide
SMILESCc1ccc(C)c(CC(=O)NOCc2ccccc2)c1
InChIInChI=1S/C17H19NO2/c1-13-8-9-14(2)16(10-13)11-17(19)18-20-12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,18,19)
InChIKeyKLJYBWDTNVRIMN-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.09
Rot. Bonds5

About 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide

2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide (PubChem CID 63102778) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide
PubChem CID63102778
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide
SMILESCc1ccc(C)c(CC(=O)NOCc2ccccc2)c1
InChIInChI=1S/C17H19NO2/c1-13-8-9-14(2)16(10-13)11-17(19)18-20-12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,18,19)
InChIKeyKLJYBWDTNVRIMN-UHFFFAOYSA-N
XLogP3.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-methylphenyl)-N-phenylmethoxyacetamide
CID 32578031
2-(2,5-dimethylphenyl)sulfanyl-N-phenylmethoxyacetamide
CID 32577082
2,5-dimethyl-N-phenylmethoxybenzamide
CID 9227271
2-(2,5-dimethylphenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 46769353
2-bromo-5-methyl-N-phenylmethoxybenzamide
CID 80962365
2-(3-aminophenyl)-N-phenylmethoxyacetamide
CID 65350168
2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide
CID 43905087
N-benzyl-2-[[2-(2,5-dimethylphenyl)acetyl]amino]benzamide
CID 92646177
2-(3,4-dichlorophenyl)-N-phenylmethoxyacetamide
CID 8908973
3,4-dimethyl-N-[2-oxo-2-(phenylmethoxyamino)ethyl]benzamide
CID 51220295
2,5-dimethyl-N-phenylmethoxyaniline
CID 88670805
2-(4-chloro-2,6-dimethylphenoxy)-N-phenylmethoxyacetamide
CID 9227392

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide (CID 63102778) is 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide is Cc1ccc(C)c(CC(=O)NOCc2ccccc2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide?
The InChIKey is KLJYBWDTNVRIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-13-8-9-14(2)16(10-13)11-17(19)18-20-12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,18,19).
What are the key properties of 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide?
2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide has a molecular weight of 269.34 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide is sourced from PubChem (CID 63102778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).