2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone

C23H18N2O4 — CID 16735553

IUPAC2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone
SMILESO=C(COc1cccc(OCc2ccccc2)c1)c1ncc(-c2ccccn2)o1
InChIInChI=1S/C23H18N2O4/c26-21(23-25-14-22(29-23)20-11-4-5-12-24-20)16-28-19-10-6-9-18(13-19)27-15-17-7-2-1-3-8-17/h1-14H,15-16H2
InChIKeyWDRMYHSVWHYIDH-UHFFFAOYSA-N
MW386.41 g/mol
LogP4.58
Rot. Bonds8

About 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone

2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone (PubChem CID 16735553) has the molecular formula C23H18N2O4 and a molecular weight of 386.41 g/mol. Its IUPAC name is 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone.

Molecular Properties

Compound Name2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone
PubChem CID16735553
Molecular FormulaC23H18N2O4
Molecular Weight386.41 g/mol
Exact Mass386.13
IUPAC Name2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone
SMILESO=C(COc1cccc(OCc2ccccc2)c1)c1ncc(-c2ccccn2)o1
InChIInChI=1S/C23H18N2O4/c26-21(23-25-14-22(29-23)20-11-4-5-12-24-20)16-28-19-10-6-9-18(13-19)27-15-17-7-2-1-3-8-17/h1-14H,15-16H2
InChIKeyWDRMYHSVWHYIDH-UHFFFAOYSA-N
XLogP4.58
TPSA74.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone?
The IUPAC name of 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone (CID 16735553) is 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone.
What is the SMILES notation for 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone?
The canonical SMILES for 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone is O=C(COc1cccc(OCc2ccccc2)c1)c1ncc(-c2ccccn2)o1.
What is the InChIKey of 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone?
The InChIKey is WDRMYHSVWHYIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O4/c26-21(23-25-14-22(29-23)20-11-4-5-12-24-20)16-28-19-10-6-9-18(13-19)27-15-17-7-2-1-3-8-17/h1-14H,15-16H2.
What are the key properties of 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone?
2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone has a molecular weight of 386.41 g/mol, XLogP of 4.58, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-phenylmethoxyphenoxy)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)ethanone is sourced from PubChem (CID 16735553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).