5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane

C10H17NO — CID 143106515

IUPAC5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane
SMILESC=CC1=C(C=C)OCCN1.CC
InChIInChI=1S/C8H11NO.C2H6/c1-3-7-8(4-2)10-6-5-9-7;1-2/h3-4,9H,1-2,5-6H2;1-2H3
InChIKeyLEMWJJZXPJPDRX-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.22
Rot. Bonds2

About 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane

5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane (PubChem CID 143106515) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane.

Molecular Properties

Compound Name5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane
PubChem CID143106515
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane
SMILESC=CC1=C(C=C)OCCN1.CC
InChIInChI=1S/C8H11NO.C2H6/c1-3-7-8(4-2)10-6-5-9-7;1-2/h3-4,9H,1-2,5-6H2;1-2H3
InChIKeyLEMWJJZXPJPDRX-UHFFFAOYSA-N
XLogP2.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane?
The IUPAC name of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane (CID 143106515) is 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane.
What is the SMILES notation for 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane?
The canonical SMILES for 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane is C=CC1=C(C=C)OCCN1.CC.
What is the InChIKey of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane?
The InChIKey is LEMWJJZXPJPDRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO.C2H6/c1-3-7-8(4-2)10-6-5-9-7;1-2/h3-4,9H,1-2,5-6H2;1-2H3.
What are the key properties of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane?
5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane has a molecular weight of 167.25 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazine;ethane is sourced from PubChem (CID 143106515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).