2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide

C17H19NO3 — CID 78765522

IUPAC2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide
SMILESCOc1cc(C)ccc1OCC(=O)N(C)c1ccccc1
InChIInChI=1S/C17H19NO3/c1-13-9-10-15(16(11-13)20-3)21-12-17(19)18(2)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3
InChIKeyREKZDRKHBWCWDU-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.05
Rot. Bonds5

About 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide

2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide (PubChem CID 78765522) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide
PubChem CID78765522
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide
SMILESCOc1cc(C)ccc1OCC(=O)N(C)c1ccccc1
InChIInChI=1S/C17H19NO3/c1-13-9-10-15(16(11-13)20-3)21-12-17(19)18(2)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3
InChIKeyREKZDRKHBWCWDU-UHFFFAOYSA-N
XLogP3.05
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyano-2-methoxyphenoxy)-N-methyl-N-phenylacetamide
CID 2492423
N,N-diethyl-2-(2-methoxy-4-methylphenoxy)acetamide
CID 60626763
[2-(N-methylanilino)-2-oxoethyl] 4-ethoxy-3-methoxybenzoate
CID 2501259
2-(4-bromo-2,5-dimethylphenoxy)-N-methyl-N-phenylacetamide
CID 3944962
2-(N-(2-methoxy-5-methylphenyl)sulfonylanilino)-N-methyl-N-phenylacetamide
CID 100796017
N-(furan-2-ylmethyl)-2-(2-methoxy-4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 31964022
2-(2-aminophenoxy)-N-methyl-N-(3-methylphenyl)acetamide
CID 62003692
2-(2-chloro-4-cyanophenoxy)-N-methyl-N-phenylacetamide
CID 8975576
N-[(3-chlorophenyl)methyl]-2-(2-methoxy-4-methylphenoxy)-N-methylacetamide
CID 78770504
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 43006220
N-[(3-fluorophenyl)methyl]-2-(2-methoxy-4-methylphenoxy)-N-methylacetamide
CID 78765534
N-butyl-N-ethyl-2-(2-methoxy-4-methylphenoxy)acetamide
CID 78785126

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide?
The IUPAC name of 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide (CID 78765522) is 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide is COc1cc(C)ccc1OCC(=O)N(C)c1ccccc1.
What is the InChIKey of 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide?
The InChIKey is REKZDRKHBWCWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-13-9-10-15(16(11-13)20-3)21-12-17(19)18(2)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3.
What are the key properties of 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide?
2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide has a molecular weight of 285.34 g/mol, XLogP of 3.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide is sourced from PubChem (CID 78765522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).