2-(ethylamino)-1-(3-methoxyphenyl)ethanone

C11H15NO2 — CID 82101988

IUPAC2-(ethylamino)-1-(3-methoxyphenyl)ethanone
SMILESCCNCC(=O)c1cccc(OC)c1
InChIInChI=1S/C11H15NO2/c1-3-12-8-11(13)9-5-4-6-10(7-9)14-2/h4-7,12H,3,8H2,1-2H3
InChIKeyRXEQGYXCWNCFED-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.49
Rot. Bonds5

About 2-(ethylamino)-1-(3-methoxyphenyl)ethanone

2-(ethylamino)-1-(3-methoxyphenyl)ethanone (PubChem CID 82101988) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-(ethylamino)-1-(3-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(ethylamino)-1-(3-methoxyphenyl)ethanone
PubChem CID82101988
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-(ethylamino)-1-(3-methoxyphenyl)ethanone
SMILESCCNCC(=O)c1cccc(OC)c1
InChIInChI=1S/C11H15NO2/c1-3-12-8-11(13)9-5-4-6-10(7-9)14-2/h4-7,12H,3,8H2,1-2H3
InChIKeyRXEQGYXCWNCFED-UHFFFAOYSA-N
XLogP1.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-1-(3-methoxyphenyl)ethanone?
The IUPAC name of 2-(ethylamino)-1-(3-methoxyphenyl)ethanone (CID 82101988) is 2-(ethylamino)-1-(3-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(ethylamino)-1-(3-methoxyphenyl)ethanone?
The canonical SMILES for 2-(ethylamino)-1-(3-methoxyphenyl)ethanone is CCNCC(=O)c1cccc(OC)c1.
What is the InChIKey of 2-(ethylamino)-1-(3-methoxyphenyl)ethanone?
The InChIKey is RXEQGYXCWNCFED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-3-12-8-11(13)9-5-4-6-10(7-9)14-2/h4-7,12H,3,8H2,1-2H3.
What are the key properties of 2-(ethylamino)-1-(3-methoxyphenyl)ethanone?
2-(ethylamino)-1-(3-methoxyphenyl)ethanone has a molecular weight of 193.25 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-1-(3-methoxyphenyl)ethanone is sourced from PubChem (CID 82101988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).