2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide

C18H21NO2 — CID 19172570

IUPAC2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide
SMILESCc1cccc(OCC(=O)NC(C)c2ccccc2)c1C
InChIInChI=1S/C18H21NO2/c1-13-8-7-11-17(14(13)2)21-12-18(20)19-15(3)16-9-5-4-6-10-16/h4-11,15H,12H2,1-3H3,(H,19,20)
InChIKeyQFYOECVCTYVZQO-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.56
Rot. Bonds5

About 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide

2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide (PubChem CID 19172570) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide
PubChem CID19172570
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide
SMILESCc1cccc(OCC(=O)NC(C)c2ccccc2)c1C
InChIInChI=1S/C18H21NO2/c1-13-8-7-11-17(14(13)2)21-12-18(20)19-15(3)16-9-5-4-6-10-16/h4-11,15H,12H2,1-3H3,(H,19,20)
InChIKeyQFYOECVCTYVZQO-UHFFFAOYSA-N
XLogP3.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide
CID 132650068
2-(2,3-dimethylphenoxy)-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 17326921
(2S)-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]propanoic acid
CID 9156872
2-(2-methylphenoxy)-N-[(1S)-1-(4-methylphenyl)ethyl]acetamide
CID 94012505
2-naphthalen-1-yloxy-N-(1-phenylethyl)acetamide
CID 4513591
2-(2-ethoxyphenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 731794
[2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 7982164
2-(2-chlorophenoxy)-N-(1-phenylethyl)acetamide
CID 2787215
N-[(2R)-butan-2-yl]-2-(2,3-dimethylphenoxy)acetamide
CID 728123
(2S,3R)-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-3-hydroxybutanoic acid
CID 104964954
2-(2,3-dimethylphenoxy)-N-[1-(2-methylphenoxy)propan-2-yl]acetamide
CID 132651176
2-(2-methylphenoxy)-N-[1-(4-methylsulfonylphenyl)ethyl]acetamide
CID 18096211

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide (CID 19172570) is 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide is Cc1cccc(OCC(=O)NC(C)c2ccccc2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide?
The InChIKey is QFYOECVCTYVZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13-8-7-11-17(14(13)2)21-12-18(20)19-15(3)16-9-5-4-6-10-16/h4-11,15H,12H2,1-3H3,(H,19,20).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide?
2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide has a molecular weight of 283.37 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 19172570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).