5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane

C13H23NO — CID 145326246

IUPAC5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane
SMILESC/C=C\C1=C(/C=C\C)OCNC1.CCC
InChIInChI=1S/C10H15NO.C3H8/c1-3-5-9-7-11-8-12-10(9)6-4-2;1-3-2/h3-6,11H,7-8H2,1-2H3;3H2,1-2H3/b5-3-,6-4-;
InChIKeyGHCRSKIJABDVLX-VIOUERSGSA-N
MW209.33 g/mol
LogP3.39
Rot. Bonds2

About 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane

5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane (PubChem CID 145326246) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane.

Molecular Properties

Compound Name5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane
PubChem CID145326246
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane
SMILESC/C=C\C1=C(/C=C\C)OCNC1.CCC
InChIInChI=1S/C10H15NO.C3H8/c1-3-5-9-7-11-8-12-10(9)6-4-2;1-3-2/h3-6,11H,7-8H2,1-2H3;3H2,1-2H3/b5-3-,6-4-;
InChIKeyGHCRSKIJABDVLX-VIOUERSGSA-N
XLogP3.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane?
The IUPAC name of 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane (CID 145326246) is 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane.
What is the SMILES notation for 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane?
The canonical SMILES for 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane is C/C=C\C1=C(/C=C\C)OCNC1.CCC.
What is the InChIKey of 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane?
The InChIKey is GHCRSKIJABDVLX-VIOUERSGSA-N. The full InChI is InChI=1S/C10H15NO.C3H8/c1-3-5-9-7-11-8-12-10(9)6-4-2;1-3-2/h3-6,11H,7-8H2,1-2H3;3H2,1-2H3/b5-3-,6-4-;.
What are the key properties of 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane?
5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane has a molecular weight of 209.33 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine;propane is sourced from PubChem (CID 145326246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).