2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide

C20H25NO3 — CID 43885247

IUPAC2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide
SMILESCCOc1ccccc1CNC(=O)C(C)Oc1cccc(C)c1C
InChIInChI=1S/C20H25NO3/c1-5-23-19-11-7-6-10-17(19)13-21-20(22)16(4)24-18-12-8-9-14(2)15(18)3/h6-12,16H,5,13H2,1-4H3,(H,21,22)
InChIKeyLAEONCUHEJGOJJ-UHFFFAOYSA-N
MW327.42 g/mol
LogP3.79
Rot. Bonds7

About 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide

2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide (PubChem CID 43885247) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide
PubChem CID43885247
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide
SMILESCCOc1ccccc1CNC(=O)C(C)Oc1cccc(C)c1C
InChIInChI=1S/C20H25NO3/c1-5-23-19-11-7-6-10-17(19)13-21-20(22)16(4)24-18-12-8-9-14(2)15(18)3/h6-12,16H,5,13H2,1-4H3,(H,21,22)
InChIKeyLAEONCUHEJGOJJ-UHFFFAOYSA-N
XLogP3.79
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dimethylphenoxy)-N-(naphthalen-1-ylmethyl)propanamide
CID 133218986
(2R)-N-[(2-ethoxyphenyl)methyl]-2-naphthalen-1-yloxypropanamide
CID 94015852
(2R)-N-benzyl-2-(2,3-dimethylphenoxy)propanamide
CID 888814
(2R)-N-[(2-ethoxyphenyl)methyl]-2-(3-methylphenoxy)propanamide
CID 92679385
(2S)-2-(2,3-dimethylphenoxy)-N-[(3-ethoxyphenyl)methyl]propanamide
CID 99131504
N-[(2-ethoxyphenyl)methyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133201955
(2S)-N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenoxy)propanamide
CID 94472552
(2S)-N-[(2-ethoxyphenyl)methyl]-2-(2-methylphenoxy)butanamide
CID 92682211
N-[(2-ethoxyphenyl)methyl]-2-(2-methylphenoxy)butanamide
CID 53284919
(2S)-N-[(4-chlorophenyl)methyl]-2-(2,3-dimethylphenoxy)propanamide
CID 26546234
(2R)-N-[(2-methylphenyl)methyl]-2-(2,3,5-trimethylphenoxy)propanamide
CID 92675244
(2S)-N-(2,6-dimethylphenyl)-2-(2-ethoxyphenoxy)propanamide
CID 40872944

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide (CID 43885247) is 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide is CCOc1ccccc1CNC(=O)C(C)Oc1cccc(C)c1C.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide?
The InChIKey is LAEONCUHEJGOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-5-23-19-11-7-6-10-17(19)13-21-20(22)16(4)24-18-12-8-9-14(2)15(18)3/h6-12,16H,5,13H2,1-4H3,(H,21,22).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide?
2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide has a molecular weight of 327.42 g/mol, XLogP of 3.79, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-[(2-ethoxyphenyl)methyl]propanamide is sourced from PubChem (CID 43885247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).