5-phenyl-2-prop-1-enyl-1,3-oxazole

C12H11NO — CID 74062032

IUPAC5-phenyl-2-prop-1-enyl-1,3-oxazole
SMILESCC=Cc1ncc(-c2ccccc2)o1
InChIInChI=1S/C12H11NO/c1-2-6-12-13-9-11(14-12)10-7-4-3-5-8-10/h2-9H,1H3
InChIKeyQJILXTKUZYGHQZ-UHFFFAOYSA-N
MW185.23 g/mol
LogP3.37
Rot. Bonds2

About 5-phenyl-2-prop-1-enyl-1,3-oxazole

5-phenyl-2-prop-1-enyl-1,3-oxazole (PubChem CID 74062032) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is 5-phenyl-2-prop-1-enyl-1,3-oxazole.

Molecular Properties

Compound Name5-phenyl-2-prop-1-enyl-1,3-oxazole
PubChem CID74062032
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name5-phenyl-2-prop-1-enyl-1,3-oxazole
SMILESCC=Cc1ncc(-c2ccccc2)o1
InChIInChI=1S/C12H11NO/c1-2-6-12-13-9-11(14-12)10-7-4-3-5-8-10/h2-9H,1H3
InChIKeyQJILXTKUZYGHQZ-UHFFFAOYSA-N
XLogP3.37
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-phenyl-2-prop-1-enyl-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

Related Compounds

5-phenyl-1,3-oxazole-2-carbaldehyde
CID 13352176
5-(4-methoxyphenyl)-2-[(E)-2-phenylethenyl]-1,3-oxazole
CID 12639615
2-methoxy-5-phenyl-1,3-oxazole
CID 69332700
2-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methyl-5-(4-methylphenyl)-1,3,4-oxadiazole;2-methyl-5-phenyl-1,3-oxazole;5-phenyl-2-[(E)-prop-1-enyl]-1,3-oxazole;2-[(E)-prop-1-enyl]-1,3-benzoxazole
CID 161396824
5-(4-methylphenyl)-2-phenyl-1,3-oxazole
CID 3946772
5-(4-phenylphenyl)-1,3-oxazol-2-amine
CID 82291590
(1R)-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
CID 138039801
N-tert-butyl-5-phenyl-1,3-oxazol-2-amine
CID 12707556
2-(1-methylquinolin-1-ium-4-yl)-5-phenyl-1,3-oxazole
CID 6611621
N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine
CID 65181733
1-(5-phenyl-1,3-oxazol-2-yl)butan-1-one
CID 10943870
sodium 5-phenyl-1,3-oxazole-2-carboxylate
CID 71755872

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-2-prop-1-enyl-1,3-oxazole?
The IUPAC name of 5-phenyl-2-prop-1-enyl-1,3-oxazole (CID 74062032) is 5-phenyl-2-prop-1-enyl-1,3-oxazole.
What is the SMILES notation for 5-phenyl-2-prop-1-enyl-1,3-oxazole?
The canonical SMILES for 5-phenyl-2-prop-1-enyl-1,3-oxazole is CC=Cc1ncc(-c2ccccc2)o1.
What is the InChIKey of 5-phenyl-2-prop-1-enyl-1,3-oxazole?
The InChIKey is QJILXTKUZYGHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c1-2-6-12-13-9-11(14-12)10-7-4-3-5-8-10/h2-9H,1H3.
What are the key properties of 5-phenyl-2-prop-1-enyl-1,3-oxazole?
5-phenyl-2-prop-1-enyl-1,3-oxazole has a molecular weight of 185.23 g/mol, XLogP of 3.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-2-prop-1-enyl-1,3-oxazole is sourced from PubChem (CID 74062032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).