1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone

C15H23NO3 — CID 82002145

IUPAC1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone
SMILESCCN(CC)CCOc1cc(OC)ccc1C(C)=O
InChIInChI=1S/C15H23NO3/c1-5-16(6-2)9-10-19-15-11-13(18-4)7-8-14(15)12(3)17/h7-8,11H,5-6,9-10H2,1-4H3
InChIKeyUBDUXOBYPVZLLO-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.62
Rot. Bonds8

About 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone

1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone (PubChem CID 82002145) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone.

Molecular Properties

Compound Name1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone
PubChem CID82002145
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone
SMILESCCN(CC)CCOc1cc(OC)ccc1C(C)=O
InChIInChI=1S/C15H23NO3/c1-5-16(6-2)9-10-19-15-11-13(18-4)7-8-14(15)12(3)17/h7-8,11H,5-6,9-10H2,1-4H3
InChIKeyUBDUXOBYPVZLLO-UHFFFAOYSA-N
XLogP2.62
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[2-(diethylamino)ethoxy]-2-hydroxyphenyl]ethanone
CID 24383
1-[4-methoxy-2-(2-propylsulfonylethoxy)phenyl]ethanone
CID 106725008
[2-[2-(diethylamino)ethoxy]-5-methoxyphenyl]methanol
CID 43267964
4-[2-(diethylamino)ethoxy]-6-methoxy-1-methylnaphthalene-2-carboxylic acid
CID 54265250
1-[4-methoxy-2-[2-(trifluoromethoxy)ethoxy]phenyl]ethanone
CID 82001830
4-amino-2-[2-(diethylamino)ethoxy]benzoic acid
CID 56992725
2-[2-(dimethylamino)ethoxy]-4-methoxybenzoyl chloride
CID 39260609
2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine
CID 43268159
1-(4-methoxy-2-pentan-3-yloxyphenyl)ethanone
CID 82001376
1-[4-methoxy-2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]ethanone
CID 82886096
1-[2-(3-imidazol-1-ylpropoxy)-4-methoxyphenyl]ethanone
CID 82001062
1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine
CID 82000221

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone?
The IUPAC name of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone (CID 82002145) is 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone.
What is the SMILES notation for 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone?
The canonical SMILES for 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone is CCN(CC)CCOc1cc(OC)ccc1C(C)=O.
What is the InChIKey of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone?
The InChIKey is UBDUXOBYPVZLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-5-16(6-2)9-10-19-15-11-13(18-4)7-8-14(15)12(3)17/h7-8,11H,5-6,9-10H2,1-4H3.
What are the key properties of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone?
1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone has a molecular weight of 265.35 g/mol, XLogP of 2.62, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone is sourced from PubChem (CID 82002145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).