4-ethenyl-3,5-dimethyl-1,2-oxazole

C7H9NO — CID 910190

IUPAC4-ethenyl-3,5-dimethyl-1,2-oxazole
SMILESC=Cc1c(C)noc1C
InChIInChI=1S/C7H9NO/c1-4-7-5(2)8-9-6(7)3/h4H,1H2,2-3H3
InChIKeyRYIHZFZTDJNDGM-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.93
Rot. Bonds1

About 4-ethenyl-3,5-dimethyl-1,2-oxazole

4-ethenyl-3,5-dimethyl-1,2-oxazole (PubChem CID 910190) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 4-ethenyl-3,5-dimethyl-1,2-oxazole.

Molecular Properties

Compound Name4-ethenyl-3,5-dimethyl-1,2-oxazole
PubChem CID910190
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name4-ethenyl-3,5-dimethyl-1,2-oxazole
SMILESC=Cc1c(C)noc1C
InChIInChI=1S/C7H9NO/c1-4-7-5(2)8-9-6(7)3/h4H,1H2,2-3H3
InChIKeyRYIHZFZTDJNDGM-UHFFFAOYSA-N
XLogP1.93
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-ethenyl-3,5-dimethyl-1,2-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

3,4,5-Trimethylisoxazole
CID 25375
Isoxazole, 4-(chloromethyl)-3,5-dimethyl-
CID 88246
4-Ethynyl-3,5-dimethyl-1,2-oxazole
CID 53426609
3,5-Dimethylisoxazole-4-carbonitrile
CID 2776140
(Dimethyl-1,2-oxazol-4-yl)methanamine
CID 11018874
2-(Dimethyl-1,2-oxazol-4-yl)acetonitrile
CID 13792858
2-(3,5-Dimethyl-1,2-oxazol-4-yl)ethane-1-thiol
CID 25219629
(3,5-Dimethyl-1,2-oxazol-4-yl)methyl selenocyanate
CID 134153821
4-(Bromomethyl)-3,5-dimethyl-1,2-oxazole
CID 12793289
(1E,4E)-1,5-bis(3,5-dimethyl-1,2-oxazol-4-yl)penta-1,4-dien-3-one
CID 87055083
5-(Difluoromethyl)-3,4-dimethyl-1,2-oxazole
CID 90397373
(3,5-Dimethylisoxazol-4-yl)methanethiol
CID 2507881

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-3,5-dimethyl-1,2-oxazole?
The IUPAC name of 4-ethenyl-3,5-dimethyl-1,2-oxazole (CID 910190) is 4-ethenyl-3,5-dimethyl-1,2-oxazole.
What is the SMILES notation for 4-ethenyl-3,5-dimethyl-1,2-oxazole?
The canonical SMILES for 4-ethenyl-3,5-dimethyl-1,2-oxazole is C=Cc1c(C)noc1C.
What is the InChIKey of 4-ethenyl-3,5-dimethyl-1,2-oxazole?
The InChIKey is RYIHZFZTDJNDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-4-7-5(2)8-9-6(7)3/h4H,1H2,2-3H3.
What are the key properties of 4-ethenyl-3,5-dimethyl-1,2-oxazole?
4-ethenyl-3,5-dimethyl-1,2-oxazole has a molecular weight of 123.15 g/mol, XLogP of 1.93, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-3,5-dimethyl-1,2-oxazole is sourced from PubChem (CID 910190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).