2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone

C15H21NO3 — CID 43797594

IUPAC2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone
SMILESCCC1COCCN1CC(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H21NO3/c1-3-13-11-19-9-8-16(13)10-15(17)12-4-6-14(18-2)7-5-12/h4-7,13H,3,8-11H2,1-2H3
InChIKeyJYGSNTIEACRDSZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.99
Rot. Bonds5

About 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone

2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone (PubChem CID 43797594) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone
PubChem CID43797594
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone
SMILESCCC1COCCN1CC(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H21NO3/c1-3-13-11-19-9-8-16(13)10-15(17)12-4-6-14(18-2)7-5-12/h4-7,13H,3,8-11H2,1-2H3
InChIKeyJYGSNTIEACRDSZ-UHFFFAOYSA-N
XLogP1.99
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone?
The IUPAC name of 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone (CID 43797594) is 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone?
The canonical SMILES for 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone is CCC1COCCN1CC(=O)c1ccc(OC)cc1.
What is the InChIKey of 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone?
The InChIKey is JYGSNTIEACRDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-3-13-11-19-9-8-16(13)10-15(17)12-4-6-14(18-2)7-5-12/h4-7,13H,3,8-11H2,1-2H3.
What are the key properties of 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone?
2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone has a molecular weight of 263.34 g/mol, XLogP of 1.99, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylmorpholin-4-yl)-1-(4-methoxyphenyl)ethanone is sourced from PubChem (CID 43797594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).