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

C8H11NO — CID 143414479

IUPAC4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole
SMILESC=CC1=C(C=C)OC(C)N1
InChIInChI=1S/C8H11NO/c1-4-7-8(5-2)10-6(3)9-7/h4-6,9H,1-2H2,3H3
InChIKeyYVDRPVCULRVXOP-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.54
Rot. Bonds2

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

4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole (PubChem CID 143414479) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole.

Molecular Properties

Compound Name4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole
PubChem CID143414479
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole
SMILESC=CC1=C(C=C)OC(C)N1
InChIInChI=1S/C8H11NO/c1-4-7-8(5-2)10-6(3)9-7/h4-6,9H,1-2H2,3H3
InChIKeyYVDRPVCULRVXOP-UHFFFAOYSA-N
XLogP1.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.54
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-methyl-2,3-dihydro-1,3-oxazole?
The IUPAC name of 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole (CID 143414479) is 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole.
What is the SMILES notation for 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole?
The canonical SMILES for 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole is C=CC1=C(C=C)OC(C)N1.
What is the InChIKey of 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole?
The InChIKey is YVDRPVCULRVXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-4-7-8(5-2)10-6(3)9-7/h4-6,9H,1-2H2,3H3.
What are the key properties of 4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole?
4,5-bis(ethenyl)-2-methyl-2,3-dihydro-1,3-oxazole has a molecular weight of 137.18 g/mol, XLogP of 1.54, 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-methyl-2,3-dihydro-1,3-oxazole is sourced from PubChem (CID 143414479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).