ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one

C12H19NO2 — CID 143371911

IUPACethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one
SMILESC=C.C=C/C(=C\C)CN1CCOCC1=O
InChIInChI=1S/C10H15NO2.C2H4/c1-3-9(4-2)7-11-5-6-13-8-10(11)12;1-2/h3-4H,1,5-8H2,2H3;1-2H2/b9-4+;
InChIKeyPZBMDIUSASZSBI-JOKMOOFLSA-N
MW209.29 g/mol
LogP1.78
Rot. Bonds3

About ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one

ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one (PubChem CID 143371911) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one.

Molecular Properties

Compound Nameethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one
PubChem CID143371911
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Nameethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one
SMILESC=C.C=C/C(=C\C)CN1CCOCC1=O
InChIInChI=1S/C10H15NO2.C2H4/c1-3-9(4-2)7-11-5-6-13-8-10(11)12;1-2/h3-4H,1,5-8H2,2H3;1-2H2/b9-4+;
InChIKeyPZBMDIUSASZSBI-JOKMOOFLSA-N
XLogP1.78
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one
CID 79468968
acetylene;ethane;4-propylmorpholin-3-one
CID 142466574
4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one
CID 134406169
4-(2,2-dimethylpropyl)morpholin-3-one
CID 59172197
4-[2-(1-methylpyrrol-3-yl)-2-oxoethyl]morpholin-3-one
CID 79467616
molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide
CID 153346596
2-acetamido-3-(3-oxomorpholin-4-yl)propanoic acid
CID 79469214
2-(3-oxomorpholin-4-yl)ethanolate
CID 142382646
4-(3-methylbutyl)morpholin-3-one
CID 58222536
4-decylmorpholin-3-one
CID 154372852
N-(4-aminophenyl)-N-methyl-2-(3-oxomorpholin-4-yl)acetamide
CID 79468372
benzyl 2-(3-oxomorpholin-4-yl)acetate;2-(3-oxomorpholin-4-yl)acetic acid
CID 158991156

Frequently Asked Questions

What is the IUPAC name of ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one?
The IUPAC name of ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one (CID 143371911) is ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one.
What is the SMILES notation for ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one?
The canonical SMILES for ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one is C=C.C=C/C(=C\C)CN1CCOCC1=O.
What is the InChIKey of ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one?
The InChIKey is PZBMDIUSASZSBI-JOKMOOFLSA-N. The full InChI is InChI=1S/C10H15NO2.C2H4/c1-3-9(4-2)7-11-5-6-13-8-10(11)12;1-2/h3-4H,1,5-8H2,2H3;1-2H2/b9-4+;.
What are the key properties of ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one?
ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one has a molecular weight of 209.29 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one is sourced from PubChem (CID 143371911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).