1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone

C15H15NO3 — CID 83119038

IUPAC1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone
SMILESCCOc1ccc(Oc2ccc(C(C)=O)nc2)cc1
InChIInChI=1S/C15H15NO3/c1-3-18-12-4-6-13(7-5-12)19-14-8-9-15(11(2)17)16-10-14/h4-10H,3H2,1-2H3
InChIKeyHPXFXGFLDQUGSD-UHFFFAOYSA-N
MW257.29 g/mol
LogP3.48
Rot. Bonds5

About 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone

1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone (PubChem CID 83119038) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone.

Molecular Properties

Compound Name1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone
PubChem CID83119038
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone
SMILESCCOc1ccc(Oc2ccc(C(C)=O)nc2)cc1
InChIInChI=1S/C15H15NO3/c1-3-18-12-4-6-13(7-5-12)19-14-8-9-15(11(2)17)16-10-14/h4-10H,3H2,1-2H3
InChIKeyHPXFXGFLDQUGSD-UHFFFAOYSA-N
XLogP3.48
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[5-[(6-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanone
CID 83119787
1-[5-(3,5-dimethylphenoxy)-2-pyridinyl]ethanone
CID 83119321
1-[5-(4-chloro-3-ethylphenoxy)-2-pyridinyl]ethanone
CID 83119327
1-[5-(3,5-difluorophenoxy)-2-pyridinyl]ethanone
CID 83118767
5-(4-ethoxyphenoxy)pyridine-2-carboximidamide
CID 115489787
1-[5-[(5-chloro-3-pyridinyl)oxy]-2-pyridinyl]ethanone
CID 83120272
1-[5-[2-(hydroxymethyl)phenoxy]-2-pyridinyl]ethanone
CID 83119591
1-[5-(4-aminobutoxy)-2-pyridinyl]ethanone
CID 142409466
5-(4-propoxyphenoxy)pyridine-2-carbothioamide
CID 115488868
1-[5-(4-aminobutoxy)-2-pyridinyl]ethanone;ethane
CID 142409465
1-[5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-2-pyridinyl]ethanone
CID 112587862
1-(5-but-3-ynoxy-2-pyridinyl)ethanone
CID 106795026

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone?
The IUPAC name of 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone (CID 83119038) is 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone.
What is the SMILES notation for 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone?
The canonical SMILES for 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone is CCOc1ccc(Oc2ccc(C(C)=O)nc2)cc1.
What is the InChIKey of 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone?
The InChIKey is HPXFXGFLDQUGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-3-18-12-4-6-13(7-5-12)19-14-8-9-15(11(2)17)16-10-14/h4-10H,3H2,1-2H3.
What are the key properties of 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone?
1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone has a molecular weight of 257.29 g/mol, XLogP of 3.48, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-ethoxyphenoxy)-2-pyridinyl]ethanone is sourced from PubChem (CID 83119038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).