2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole

C17H17NO2 — CID 14853172

IUPAC2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole
SMILESCCOc1ccccc1C1=NC(c2ccccc2)CO1
InChIInChI=1S/C17H17NO2/c1-2-19-16-11-7-6-10-14(16)17-18-15(12-20-17)13-8-4-3-5-9-13/h3-11,15H,2,12H2,1H3
InChIKeyHFBYEWCRVYBTHY-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.60
Rot. Bonds4

About 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole

2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole (PubChem CID 14853172) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole
PubChem CID14853172
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole
SMILESCCOc1ccccc1C1=NC(c2ccccc2)CO1
InChIInChI=1S/C17H17NO2/c1-2-19-16-11-7-6-10-14(16)17-18-15(12-20-17)13-8-4-3-5-9-13/h3-11,15H,2,12H2,1H3
InChIKeyHFBYEWCRVYBTHY-UHFFFAOYSA-N
XLogP3.60
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole?
The IUPAC name of 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole (CID 14853172) is 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole is CCOc1ccccc1C1=NC(c2ccccc2)CO1.
What is the InChIKey of 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole?
The InChIKey is HFBYEWCRVYBTHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-2-19-16-11-7-6-10-14(16)17-18-15(12-20-17)13-8-4-3-5-9-13/h3-11,15H,2,12H2,1H3.
What are the key properties of 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole?
2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole has a molecular weight of 267.33 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 14853172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).