N-[(2-methylphenyl)methyl]-2-phenoxyacetamide

C16H17NO2 — CID 778125

IUPACN-[(2-methylphenyl)methyl]-2-phenoxyacetamide
SMILESCc1ccccc1CNC(=O)COc1ccccc1
InChIInChI=1S/C16H17NO2/c1-13-7-5-6-8-14(13)11-17-16(18)12-19-15-9-3-2-4-10-15/h2-10H,11-12H2,1H3,(H,17,18)
InChIKeyUKELNCJRDVNNAJ-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.69
Rot. Bonds5

About N-[(2-methylphenyl)methyl]-2-phenoxyacetamide

N-[(2-methylphenyl)methyl]-2-phenoxyacetamide (PubChem CID 778125) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]-2-phenoxyacetamide
PubChem CID778125
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-[(2-methylphenyl)methyl]-2-phenoxyacetamide
SMILESCc1ccccc1CNC(=O)COc1ccccc1
InChIInChI=1S/C16H17NO2/c1-13-7-5-6-8-14(13)11-17-16(18)12-19-15-9-3-2-4-10-15/h2-10H,11-12H2,1H3,(H,17,18)
InChIKeyUKELNCJRDVNNAJ-UHFFFAOYSA-N
XLogP2.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]-2-phenoxyacetamide?
The IUPAC name of N-[(2-methylphenyl)methyl]-2-phenoxyacetamide (CID 778125) is N-[(2-methylphenyl)methyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[(2-methylphenyl)methyl]-2-phenoxyacetamide?
The canonical SMILES for N-[(2-methylphenyl)methyl]-2-phenoxyacetamide is Cc1ccccc1CNC(=O)COc1ccccc1.
What is the InChIKey of N-[(2-methylphenyl)methyl]-2-phenoxyacetamide?
The InChIKey is UKELNCJRDVNNAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-13-7-5-6-8-14(13)11-17-16(18)12-19-15-9-3-2-4-10-15/h2-10H,11-12H2,1H3,(H,17,18).
What are the key properties of N-[(2-methylphenyl)methyl]-2-phenoxyacetamide?
N-[(2-methylphenyl)methyl]-2-phenoxyacetamide has a molecular weight of 255.32 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]-2-phenoxyacetamide is sourced from PubChem (CID 778125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).