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

C9H15NO — CID 142019666

IUPAC4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane
SMILESC=CC1=C(C=C)OCN1.CC
InChIInChI=1S/C7H9NO.C2H6/c1-3-6-7(4-2)9-5-8-6;1-2/h3-4,8H,1-2,5H2;1-2H3
InChIKeyNJBIBLCNAVAXTP-UHFFFAOYSA-N
MW153.22 g/mol
LogP2.17
Rot. Bonds2

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

4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane (PubChem CID 142019666) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane.

Molecular Properties

Compound Name4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane
PubChem CID142019666
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane
SMILESC=CC1=C(C=C)OCN1.CC
InChIInChI=1S/C7H9NO.C2H6/c1-3-6-7(4-2)9-5-8-6;1-2/h3-4,8H,1-2,5H2;1-2H3
InChIKeyNJBIBLCNAVAXTP-UHFFFAOYSA-N
XLogP2.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane?
The IUPAC name of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane (CID 142019666) is 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane.
What is the SMILES notation for 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane?
The canonical SMILES for 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane is C=CC1=C(C=C)OCN1.CC.
What is the InChIKey of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane?
The InChIKey is NJBIBLCNAVAXTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO.C2H6/c1-3-6-7(4-2)9-5-8-6;1-2/h3-4,8H,1-2,5H2;1-2H3.
What are the key properties of 4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane?
4,5-bis(ethenyl)-2,3-dihydro-1,3-oxazole;ethane has a molecular weight of 153.22 g/mol, XLogP of 2.17, 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;ethane is sourced from PubChem (CID 142019666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).