2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide

C15H21NO4 — CID 18161044

IUPAC2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)Cc1cc(C(C)=O)ccc1OC
InChIInChI=1S/C15H21NO4/c1-10(9-19-3)16-15(18)8-13-7-12(11(2)17)5-6-14(13)20-4/h5-7,10H,8-9H2,1-4H3,(H,16,18)
InChIKeyCQYZPOVEURYUAE-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.59
Rot. Bonds7

About 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide

2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 18161044) has the molecular formula C15H21NO4 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide
PubChem CID18161044
Molecular FormulaC15H21NO4
Molecular Weight279.34 g/mol
Exact Mass279.15
IUPAC Name2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)Cc1cc(C(C)=O)ccc1OC
InChIInChI=1S/C15H21NO4/c1-10(9-19-3)16-15(18)8-13-7-12(11(2)17)5-6-14(13)20-4/h5-7,10H,8-9H2,1-4H3,(H,16,18)
InChIKeyCQYZPOVEURYUAE-UHFFFAOYSA-N
XLogP1.59
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-5-methylphenyl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 39969472
(2S,3S)-2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-3-methylpentanoic acid
CID 119194209
2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-3-methylpentanoic acid
CID 119211962
2-(5-acetyl-2-methoxyphenyl)-N-(1-amino-4-methylpentan-2-yl)acetamide
CID 119585445
2-(5-acetyl-2-methoxyphenyl)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120830590
2-(5-acetyl-2-methoxyphenyl)acetic acid
CID 2535148
2-(5-acetyl-2-methoxyphenyl)-N-(2-amino-1-cyclopropylethyl)acetamide
CID 119612751
2-(4-acetylphenoxy)-N-(1-methoxypropan-2-yl)acetamide
CID 51140295
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dimethoxyphenyl)acetamide
CID 16557440
4-methoxy-N-(1-methoxypropan-2-yl)-3-(propoxymethyl)benzamide
CID 133179107
1-[3-(hydroxymethyl)-4-methoxyphenyl]ethanone
CID 4689851
2-(5-acetyl-2-methoxyphenyl)-N-[(2S)-1-pyrrolidin-1-ylbutan-2-yl]acetamide
CID 51505135

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide (CID 18161044) is 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide is COCC(C)NC(=O)Cc1cc(C(C)=O)ccc1OC.
What is the InChIKey of 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is CQYZPOVEURYUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO4/c1-10(9-19-3)16-15(18)8-13-7-12(11(2)17)5-6-14(13)20-4/h5-7,10H,8-9H2,1-4H3,(H,16,18).
What are the key properties of 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide?
2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 279.34 g/mol, XLogP of 1.59, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2-methoxyphenyl)-N-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 18161044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).