2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide

C18H21NO4 — CID 112977714

IUPAC2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
SMILESCCOc1cccc(OCC(=O)NCc2ccc(OC)cc2)c1
InChIInChI=1S/C18H21NO4/c1-3-22-16-5-4-6-17(11-16)23-13-18(20)19-12-14-7-9-15(21-2)10-8-14/h4-11H,3,12-13H2,1-2H3,(H,19,20)
InChIKeyYLAVMABJWHHWIL-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.79
Rot. Bonds8

About 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide

2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide (PubChem CID 112977714) has the molecular formula C18H21NO4 and a molecular weight of 315.37 g/mol. Its IUPAC name is 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
PubChem CID112977714
Molecular FormulaC18H21NO4
Molecular Weight315.37 g/mol
Exact Mass315.15
IUPAC Name2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
SMILESCCOc1cccc(OCC(=O)NCc2ccc(OC)cc2)c1
InChIInChI=1S/C18H21NO4/c1-3-22-16-5-4-6-17(11-16)23-13-18(20)19-12-14-7-9-15(21-2)10-8-14/h4-11H,3,12-13H2,1-2H3,(H,19,20)
InChIKeyYLAVMABJWHHWIL-UHFFFAOYSA-N
XLogP2.79
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-(3-ethoxyphenoxy)acetamide
CID 112977703
N-[(4-methoxyphenyl)methyl]-2-(3-phenoxyphenoxy)acetamide
CID 2681736
N-[(4-ethoxyphenyl)methyl]-2-(3-fluorophenoxy)acetamide
CID 110780897
2-(3-ethoxyphenoxy)-N-(pyridin-4-ylmethyl)acetamide
CID 112977719
2-(2-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
CID 16544819
N-[[4-(diethylamino)phenyl]methyl]-2-(3-methoxyphenoxy)acetamide
CID 94614124
2-(4-ethylphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495684
2-(2,6-dimethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
CID 7612549
N-[(3-ethoxyphenyl)methyl]-2-(4-fluorophenoxy)acetamide
CID 53288657
N-[(4-methoxyphenyl)methyl]-2-pyridin-3-yloxyacetamide
CID 110487955
N-[(3,5-dimethoxyphenyl)methyl]-2-naphthalen-2-yloxyacetamide
CID 55577770
2-(3-acetylphenoxy)-N-[(6-methoxynaphthalen-2-yl)methyl]acetamide
CID 30307790

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide (CID 112977714) is 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide is CCOc1cccc(OCC(=O)NCc2ccc(OC)cc2)c1.
What is the InChIKey of 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide?
The InChIKey is YLAVMABJWHHWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO4/c1-3-22-16-5-4-6-17(11-16)23-13-18(20)19-12-14-7-9-15(21-2)10-8-14/h4-11H,3,12-13H2,1-2H3,(H,19,20).
What are the key properties of 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide?
2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide has a molecular weight of 315.37 g/mol, XLogP of 2.79, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 112977714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).