6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine

C10H15NO — CID 143811812

IUPAC6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine
SMILESC=CC1=C(/C=C\CC)OCNC1
InChIInChI=1S/C10H15NO/c1-3-5-6-10-9(4-2)7-11-8-12-10/h4-6,11H,2-3,7-8H2,1H3/b6-5-
InChIKeyAJUJOPIDKJDILE-WAYWQWQTSA-N
MW165.24 g/mol
LogP1.97
Rot. Bonds3

About 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine

6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine (PubChem CID 143811812) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine.

Molecular Properties

Compound Name6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine
PubChem CID143811812
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine
SMILESC=CC1=C(/C=C\CC)OCNC1
InChIInChI=1S/C10H15NO/c1-3-5-6-10-9(4-2)7-11-8-12-10/h4-6,11H,2-3,7-8H2,1H3/b6-5-
InChIKeyAJUJOPIDKJDILE-WAYWQWQTSA-N
XLogP1.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine?
The IUPAC name of 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine (CID 143811812) is 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine.
What is the SMILES notation for 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine?
The canonical SMILES for 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine is C=CC1=C(/C=C\CC)OCNC1.
What is the InChIKey of 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine?
The InChIKey is AJUJOPIDKJDILE-WAYWQWQTSA-N. The full InChI is InChI=1S/C10H15NO/c1-3-5-6-10-9(4-2)7-11-8-12-10/h4-6,11H,2-3,7-8H2,1H3/b6-5-.
What are the key properties of 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine?
6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine has a molecular weight of 165.24 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(Z)-but-1-enyl]-5-ethenyl-3,4-dihydro-2H-1,3-oxazine is sourced from PubChem (CID 143811812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).