N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide

C15H23NO3 — CID 103601799

IUPACN-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide
SMILESCCc1ccc(CN(C)C(=O)COCCOC)cc1
InChIInChI=1S/C15H23NO3/c1-4-13-5-7-14(8-6-13)11-16(2)15(17)12-19-10-9-18-3/h5-8H,4,9-12H2,1-3H3
InChIKeyHXUCDHZMDSJPCX-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.87
Rot. Bonds8

About N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide

N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide (PubChem CID 103601799) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide
PubChem CID103601799
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide
SMILESCCc1ccc(CN(C)C(=O)COCCOC)cc1
InChIInChI=1S/C15H23NO3/c1-4-13-5-7-14(8-6-13)11-16(2)15(17)12-19-10-9-18-3/h5-8H,4,9-12H2,1-3H3
InChIKeyHXUCDHZMDSJPCX-UHFFFAOYSA-N
XLogP1.87
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethoxy)-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 103601917
2-(2-methoxyethoxy)-N-methyl-N-(naphthalen-2-ylmethyl)acetamide
CID 103601960
N-[(4-ethylphenyl)methyl]-N-methylpropanamide
CID 60630863
N-[(4-ethylphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 82126542
2-(2-aminoethoxy)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 79463095
N-[(2,4-difluorophenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide
CID 103610141
N-[[4-(aminomethyl)phenyl]methyl]-2-methoxy-N-methylacetamide
CID 61278778
2-(2-methoxyethoxy)-N-[(4-methylphenyl)methyl]-N-propylacetamide
CID 103602434
[2-[(4-ethylphenyl)methyl-methylamino]-2-oxoethyl] 4-(4-methoxyphenoxy)butanoate
CID 55402769
2-(2-aminoethoxy)-N-methyl-N-(pyridin-4-ylmethyl)acetamide
CID 79473191
2-(4-cyanophenoxy)-N-[(4-ethylphenyl)methyl]-N-methylacetamide
CID 7535470
2-[2-[(4-chlorophenyl)methyl-methylamino]-2-oxoethoxy]acetic acid
CID 54941021

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide?
The IUPAC name of N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide (CID 103601799) is N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide is CCc1ccc(CN(C)C(=O)COCCOC)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide?
The InChIKey is HXUCDHZMDSJPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-4-13-5-7-14(8-6-13)11-16(2)15(17)12-19-10-9-18-3/h5-8H,4,9-12H2,1-3H3.
What are the key properties of N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide?
N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide has a molecular weight of 265.35 g/mol, XLogP of 1.87, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-2-(2-methoxyethoxy)-N-methylacetamide is sourced from PubChem (CID 103601799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).