4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole

C7H9NO — CID 142019667

IUPAC4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole
SMILESC=CC1=C(C=C)OCN1
InChIInChI=1S/C7H9NO/c1-3-6-7(4-2)9-5-8-6/h3-4,8H,1-2,5H2
InChIKeyVTEHDAXNIRZOFM-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.15
Rot. Bonds2

About 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole

4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole (PubChem CID 142019667) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole.

Molecular Properties

Compound Name4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole
PubChem CID142019667
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole
SMILESC=CC1=C(C=C)OCN1
InChIInChI=1S/C7H9NO/c1-3-6-7(4-2)9-5-8-6/h3-4,8H,1-2,5H2
InChIKeyVTEHDAXNIRZOFM-UHFFFAOYSA-N
XLogP1.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethenyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
CID 89386699
4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
CID 139460781
4,5-Bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane
CID 142019666
ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
CID 142078831
4,5-Bis(ethenyl)-2,3-dihydro-1,3-oxazole;molecular hydrogen
CID 142291823
(3E)-4-methoxy-N-methylhexa-1,3,5-trien-2-amine
CID 142872840
4,5-bis[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole;ethane
CID 143380093
4,5-bis[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
CID 143380094
4,5-Bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole
CID 143414479
5-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
CID 143707700
(3Z)-4-methoxy-N-methylhexa-1,3,5-trien-3-amine
CID 143782118
4,5-Bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole;ethane
CID 144114733

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole?
The IUPAC name of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole (CID 142019667) is 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole.
What is the SMILES notation for 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole?
The canonical SMILES for 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole is C=CC1=C(C=C)OCN1.
What is the InChIKey of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole?
The InChIKey is VTEHDAXNIRZOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-3-6-7(4-2)9-5-8-6/h3-4,8H,1-2,5H2.
What are the key properties of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole?
4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole has a molecular weight of 123.15 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole is sourced from PubChem (CID 142019667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).