4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide

C25H21N3O4 — CID 56548513

IUPAC4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide
SMILESNC(=O)c1ccc(Oc2ccc(C(=O)NCCc3coc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C25H21N3O4/c26-23(29)17-6-10-21(11-7-17)32-22-12-8-18(9-13-22)24(30)27-15-14-20-16-31-25(28-20)19-4-2-1-3-5-19/h1-13,16H,14-15H2,(H2,26,29)(H,27,30)
InChIKeyGFXAEBPXAUBFOG-UHFFFAOYSA-N
MW427.46 g/mol
LogP4.21
Rot. Bonds8

About 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide

4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide (PubChem CID 56548513) has the molecular formula C25H21N3O4 and a molecular weight of 427.46 g/mol. Its IUPAC name is 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide.

Molecular Properties

Compound Name4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide
PubChem CID56548513
Molecular FormulaC25H21N3O4
Molecular Weight427.46 g/mol
Exact Mass427.15
IUPAC Name4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide
SMILESNC(=O)c1ccc(Oc2ccc(C(=O)NCCc3coc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C25H21N3O4/c26-23(29)17-6-10-21(11-7-17)32-22-12-8-18(9-13-22)24(30)27-15-14-20-16-31-25(28-20)19-4-2-1-3-5-19/h1-13,16H,14-15H2,(H2,26,29)(H,27,30)
InChIKeyGFXAEBPXAUBFOG-UHFFFAOYSA-N
XLogP4.21
TPSA107.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.46
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethyl]-4-(trifluoromethyl)benzamide
CID 146121971
N-[2-(2-fluorophenyl)ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39441204
1-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-3-(2-pyridin-2-ylethyl)urea
CID 60620267
N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxamide
CID 67349844
3-methoxy-N-[2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]benzamide
CID 146122399
3-chloro-5-methoxy-N-[2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethyl]benzamide
CID 146122824
4-bromo-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56564869
N-[2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethyl]-2-methylpyrazole-3-carboxamide
CID 146122184
N-[2-[[4-(4-carbamoylphenoxy)benzoyl]amino]ethyl]pyridine-3-carboxamide
CID 56545663
4-[4-[2-(2,3-dichlorophenyl)ethylcarbamoyl]phenoxy]benzamide
CID 56548908
4-[4-[2-(3-chlorophenyl)ethylcarbamoyl]phenoxy]benzamide
CID 56545147
(2R)-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 95294009

Frequently Asked Questions

What is the IUPAC name of 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide?
The IUPAC name of 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide (CID 56548513) is 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide.
What is the SMILES notation for 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide?
The canonical SMILES for 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide is NC(=O)c1ccc(Oc2ccc(C(=O)NCCc3coc(-c4ccccc4)n3)cc2)cc1.
What is the InChIKey of 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide?
The InChIKey is GFXAEBPXAUBFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3O4/c26-23(29)17-6-10-21(11-7-17)32-22-12-8-18(9-13-22)24(30)27-15-14-20-16-31-25(28-20)19-4-2-1-3-5-19/h1-13,16H,14-15H2,(H2,26,29)(H,27,30).
What are the key properties of 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide?
4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide has a molecular weight of 427.46 g/mol, XLogP of 4.21, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethylcarbamoyl]phenoxy]benzamide is sourced from PubChem (CID 56548513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).