2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide

C19H23NO3 — CID 112977879

IUPAC2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)COc2cc(C)ccc2C)c1
InChIInChI=1S/C19H23NO3/c1-14-7-8-15(2)18(11-14)23-13-19(21)20-10-9-16-5-4-6-17(12-16)22-3/h4-8,11-12H,9-10,13H2,1-3H3,(H,20,21)
InChIKeyKWRSLJLFYKEEFJ-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.05
Rot. Bonds7

About 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide

2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide (PubChem CID 112977879) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide
PubChem CID112977879
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)COc2cc(C)ccc2C)c1
InChIInChI=1S/C19H23NO3/c1-14-7-8-15(2)18(11-14)23-13-19(21)20-10-9-16-5-4-6-17(12-16)22-3/h4-8,11-12H,9-10,13H2,1-3H3,(H,20,21)
InChIKeyKWRSLJLFYKEEFJ-UHFFFAOYSA-N
XLogP3.05
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 112977913
2-(2-chloro-4-fluorophenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 112978965
N-[3-(3-methoxyphenyl)propyl]-2-(3-methylphenoxy)acetamide
CID 95172598
2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide
CID 110288618
2-[3-[[[2-(2,5-dimethylphenoxy)acetyl]amino]methyl]phenoxy]acetic acid
CID 119246591
N-[2-(3-methoxyphenyl)ethyl]-2-(2-propan-2-ylphenoxy)acetamide
CID 112977430
3-(2,4-dimethylanilino)-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 109025525
2-(2,5-dimethylphenyl)sulfinyl-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 75513079
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
2-(4-tert-butylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 112977668
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
2-(2,5-dimethylphenoxy)-N-[8-[[2-(2,5-dimethylphenoxy)acetyl]amino]octyl]acetamide
CID 17233348

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide (CID 112977879) is 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide is COc1cccc(CCNC(=O)COc2cc(C)ccc2C)c1.
What is the InChIKey of 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The InChIKey is KWRSLJLFYKEEFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-14-7-8-15(2)18(11-14)23-13-19(21)20-10-9-16-5-4-6-17(12-16)22-3/h4-8,11-12H,9-10,13H2,1-3H3,(H,20,21).
What are the key properties of 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide has a molecular weight of 313.40 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenoxy)-N-[2-(3-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 112977879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).