(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine

C19H19NO — CID 145446589

IUPAC(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine
SMILESC=C/C=C1C(=C/C)\OC(C=C)=C(C=C)N\1c1ccccc1
InChIInChI=1S/C19H19NO/c1-5-12-17-19(8-4)21-18(7-3)16(6-2)20(17)15-13-10-9-11-14-15/h5-14H,1-3H2,4H3/b17-12+,19-8+
InChIKeyQVOUOUIRXYYYDH-SPDWQDPISA-N
MW277.37 g/mol
LogP5.08
Rot. Bonds4

About (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine

(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine (PubChem CID 145446589) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine.

Molecular Properties

Compound Name(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine
PubChem CID145446589
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine
SMILESC=C/C=C1C(=C/C)\OC(C=C)=C(C=C)N\1c1ccccc1
InChIInChI=1S/C19H19NO/c1-5-12-17-19(8-4)21-18(7-3)16(6-2)20(17)15-13-10-9-11-14-15/h5-14H,1-3H2,4H3/b17-12+,19-8+
InChIKeyQVOUOUIRXYYYDH-SPDWQDPISA-N
XLogP5.08
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500277.37
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5E,6E)-2-ethenyl-5-ethylidene-1,4-diphenyl-3-[(Z)-prop-1-enyl]-6-prop-2-enylidenepyrazine
CID 142288113
2,3-bis(ethenyl)-4-phenyl-1,4-benzoxazine;ethane
CID 145383928
2,3-bis(ethenyl)-4-phenyl-1,4-benzoxazine
CID 145125517
(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-1-naphthalen-2-yl-4-phenyl-5-prop-2-enylidenepyrazine
CID 142288324
(9E,10Z)-2,3,6,7-tetrakis(ethenyl)-9-ethylidene-8-phenyl-10-prop-2-enylidene-8-azaspiro[4.5]deca-2,6-diene
CID 143027605
2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline
CID 142288460
10-[2-[2,3-bis(ethenyl)-1,4-benzoxazin-4-yl]phenyl]phenoxazine
CID 163464448
4-(4-bromophenyl)-3-ethenyl-2-[(Z)-prop-1-enyl]-1,4-benzoxazine
CID 139317797
ethane;(2E,3E)-2-ethylidene-1,4-diphenyl-5,6-bis[(Z)-prop-1-enyl]-3-prop-2-enylidenepyrazine;3-methyl-9-phenylcarbazole
CID 142288278
3-[4-[2,3-bis(ethenyl)-1,4-benzoxazin-4-yl]phenyl]propan-1-ol
CID 145210312
2,3-bis(ethenyl)-1,4-benzodioxine;ethane
CID 144875800
(5E)-N-ethenyl-5-ethylidene-2-phenyl-1,3-oxazol-4-imine
CID 170405322

Frequently Asked Questions

What is the IUPAC name of (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine?
The IUPAC name of (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine (CID 145446589) is (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine.
What is the SMILES notation for (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine?
The canonical SMILES for (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine is C=C/C=C1C(=C/C)\OC(C=C)=C(C=C)N\1c1ccccc1.
What is the InChIKey of (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine?
The InChIKey is QVOUOUIRXYYYDH-SPDWQDPISA-N. The full InChI is InChI=1S/C19H19NO/c1-5-12-17-19(8-4)21-18(7-3)16(6-2)20(17)15-13-10-9-11-14-15/h5-14H,1-3H2,4H3/b17-12+,19-8+.
What are the key properties of (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine?
(5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine has a molecular weight of 277.37 g/mol, XLogP of 5.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,6E)-2,3-bis(ethenyl)-6-ethylidene-4-phenyl-5-prop-2-enylidene-1,4-oxazine is sourced from PubChem (CID 145446589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).