4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole

C14H15NO — CID 68521449

IUPAC4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole
SMILESC=Cc1ccccc1C1COC(C(=C)C)=N1
InChIInChI=1S/C14H15NO/c1-4-11-7-5-6-8-12(11)13-9-16-14(15-13)10(2)3/h4-8,13H,1-2,9H2,3H3
InChIKeyLYYFYRZBEXKEMC-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.38
Rot. Bonds3

About 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole

4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole (PubChem CID 68521449) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole
PubChem CID68521449
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole
SMILESC=Cc1ccccc1C1COC(C(=C)C)=N1
InChIInChI=1S/C14H15NO/c1-4-11-7-5-6-8-12(11)13-9-16-14(15-13)10(2)3/h4-8,13H,1-2,9H2,3H3
InChIKeyLYYFYRZBEXKEMC-UHFFFAOYSA-N
XLogP3.38
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole?
The IUPAC name of 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole (CID 68521449) is 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole is C=Cc1ccccc1C1COC(C(=C)C)=N1.
What is the InChIKey of 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole?
The InChIKey is LYYFYRZBEXKEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-4-11-7-5-6-8-12(11)13-9-16-14(15-13)10(2)3/h4-8,13H,1-2,9H2,3H3.
What are the key properties of 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole?
4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole has a molecular weight of 213.28 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethenylphenyl)-2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 68521449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).