2-(4-ethylphenoxy)-1-morpholin-4-ylethanone

C14H19NO3 — CID 806693

IUPAC2-(4-ethylphenoxy)-1-morpholin-4-ylethanone
SMILESCCc1ccc(OCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H19NO3/c1-2-12-3-5-13(6-4-12)18-11-14(16)15-7-9-17-10-8-15/h3-6H,2,7-11H2,1H3
InChIKeyJWNHHUDPGPWYNN-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.49
Rot. Bonds4

About 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone

2-(4-ethylphenoxy)-1-morpholin-4-ylethanone (PubChem CID 806693) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-1-morpholin-4-ylethanone
PubChem CID806693
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name2-(4-ethylphenoxy)-1-morpholin-4-ylethanone
SMILESCCc1ccc(OCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H19NO3/c1-2-12-3-5-13(6-4-12)18-11-14(16)15-7-9-17-10-8-15/h3-6H,2,7-11H2,1H3
InChIKeyJWNHHUDPGPWYNN-UHFFFAOYSA-N
XLogP1.49
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone (CID 806693) is 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone is CCc1ccc(OCC(=O)N2CCOCC2)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone?
The InChIKey is JWNHHUDPGPWYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-2-12-3-5-13(6-4-12)18-11-14(16)15-7-9-17-10-8-15/h3-6H,2,7-11H2,1H3.
What are the key properties of 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone?
2-(4-ethylphenoxy)-1-morpholin-4-ylethanone has a molecular weight of 249.31 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-1-morpholin-4-ylethanone is sourced from PubChem (CID 806693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).