2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide

C15H23NO4 — CID 4733178

IUPAC2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide
SMILESCCCCOc1cccc(OCC(=O)NCCOC)c1
InChIInChI=1S/C15H23NO4/c1-3-4-9-19-13-6-5-7-14(11-13)20-12-15(17)16-8-10-18-2/h5-7,11H,3-4,8-10,12H2,1-2H3,(H,16,17)
InChIKeyGPJBSGXLYUPJDC-UHFFFAOYSA-N
MW281.35 g/mol
LogP2.01
Rot. Bonds10

About 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide

2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide (PubChem CID 4733178) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide
PubChem CID4733178
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC Name2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide
SMILESCCCCOc1cccc(OCC(=O)NCCOC)c1
InChIInChI=1S/C15H23NO4/c1-3-4-9-19-13-6-5-7-14(11-13)20-12-15(17)16-8-10-18-2/h5-7,11H,3-4,8-10,12H2,1-2H3,(H,16,17)
InChIKeyGPJBSGXLYUPJDC-UHFFFAOYSA-N
XLogP2.01
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3-methoxyphenoxy)-N-pentylacetamide
CID 19204008
N-butyl-2-(3-ethoxyphenoxy)acetamide
CID 112977682
N-ethyl-2-(3-pentoxyphenoxy)acetamide
CID 4733263
N-(2-methoxyethyl)-2-[3-[1-(propylamino)ethyl]phenoxy]acetamide
CID 61487649
2-(3-ethylphenoxy)-N-(3-methoxypropyl)acetamide
CID 60623442
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide
CID 113099802
N-[3-(dimethylamino)propyl]-2-(3-propoxyphenoxy)acetamide
CID 4733113
2-(3-carbamothioylphenoxy)-N-(2-methoxyethyl)acetamide
CID 54956323
2-(3-aminophenoxy)-N-(3-methoxypropyl)acetamide
CID 61036344
2-(3-fluorophenoxy)-N-(3-methoxypropyl)acetamide
CID 60626010
2-(4-hydroxyphenoxy)-N-(2-methoxyethyl)acetamide
CID 61485470
N-butyl-2-(4-propoxyphenoxy)acetamide
CID 112775304

Frequently Asked Questions

What is the IUPAC name of 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide (CID 4733178) is 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide is CCCCOc1cccc(OCC(=O)NCCOC)c1.
What is the InChIKey of 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide?
The InChIKey is GPJBSGXLYUPJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-3-4-9-19-13-6-5-7-14(11-13)20-12-15(17)16-8-10-18-2/h5-7,11H,3-4,8-10,12H2,1-2H3,(H,16,17).
What are the key properties of 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide?
2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide has a molecular weight of 281.35 g/mol, XLogP of 2.01, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 4733178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).