2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide

C19H23NO4 — CID 7695512

IUPAC2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide
SMILESCOc1cc(C)cc(OC)c1OCC(=O)N[C@@H](C)c1ccccc1
InChIInChI=1S/C19H23NO4/c1-13-10-16(22-3)19(17(11-13)23-4)24-12-18(21)20-14(2)15-8-6-5-7-9-15/h5-11,14H,12H2,1-4H3,(H,20,21)/t14-/m0/s1
InChIKeyXVANUHNUFNKCHF-AWEZNQCLSA-N
MW329.40 g/mol
LogP3.27
Rot. Bonds7

About 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide

2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide (PubChem CID 7695512) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide
PubChem CID7695512
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide
SMILESCOc1cc(C)cc(OC)c1OCC(=O)N[C@@H](C)c1ccccc1
InChIInChI=1S/C19H23NO4/c1-13-10-16(22-3)19(17(11-13)23-4)24-12-18(21)20-14(2)15-8-6-5-7-9-15/h5-11,14H,12H2,1-4H3,(H,20,21)/t14-/m0/s1
InChIKeyXVANUHNUFNKCHF-AWEZNQCLSA-N
XLogP3.27
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-acetyl-2-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 7732618
2-(2,6-dimethoxy-4-methylphenoxy)-N-(3,3-diphenylpropyl)acetamide
CID 7695606
2-[4-(hydroxymethyl)-2-methoxyphenoxy]-N-(1-phenylethyl)acetamide
CID 19621809
2-(5-methyl-2-propan-2-ylphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 921036
2-(2,6-dimethoxyphenoxy)-N-[1-(3,4-dimethylphenyl)ethyl]acetamide
CID 46697439
2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 836085
2-(2-ethoxyphenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 731794
N-[1-(4-fluorophenyl)ethyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 17415328
2-(3-methylphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 879297
2-(3-methoxyphenoxy)-N-(1-phenylethyl)acetamide
CID 19204047
2-methoxy-N-[(1S)-1-phenylethyl]acetamide
CID 835320
2-(5-formyl-2-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 7611853

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide?
The IUPAC name of 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide (CID 7695512) is 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide?
The canonical SMILES for 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide is COc1cc(C)cc(OC)c1OCC(=O)N[C@@H](C)c1ccccc1.
What is the InChIKey of 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide?
The InChIKey is XVANUHNUFNKCHF-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H23NO4/c1-13-10-16(22-3)19(17(11-13)23-4)24-12-18(21)20-14(2)15-8-6-5-7-9-15/h5-11,14H,12H2,1-4H3,(H,20,21)/t14-/m0/s1.
What are the key properties of 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide?
2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide has a molecular weight of 329.40 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethoxy-4-methylphenoxy)-N-[(1S)-1-phenylethyl]acetamide is sourced from PubChem (CID 7695512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).