2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide

C17H19NO2 — CID 3142634

IUPAC2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide
SMILESCOC(C(=O)NCc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C17H19NO2/c1-13-8-10-14(11-9-13)12-18-17(19)16(20-2)15-6-4-3-5-7-15/h3-11,16H,12H2,1-2H3,(H,18,19)
InChIKeyNQPGYBJMHYTASA-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.00
Rot. Bonds5

About 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide

2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide (PubChem CID 3142634) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide
PubChem CID3142634
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide
SMILESCOC(C(=O)NCc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C17H19NO2/c1-13-8-10-14(11-9-13)12-18-17(19)16(20-2)15-6-4-3-5-7-15/h3-11,16H,12H2,1-2H3,(H,18,19)
InChIKeyNQPGYBJMHYTASA-UHFFFAOYSA-N
XLogP3.00
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 ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide?
The IUPAC name of 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide (CID 3142634) is 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide.
What is the SMILES notation for 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide?
The canonical SMILES for 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide is COC(C(=O)NCc1ccc(C)cc1)c1ccccc1.
What is the InChIKey of 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide?
The InChIKey is NQPGYBJMHYTASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-13-8-10-14(11-9-13)12-18-17(19)16(20-2)15-6-4-3-5-7-15/h3-11,16H,12H2,1-2H3,(H,18,19).
What are the key properties of 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide?
2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide has a molecular weight of 269.34 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide is sourced from PubChem (CID 3142634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).