N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one

C12H20N2O3 — CID 141284546

IUPACN-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one
SMILESC=CC(=O)N1CCOCC1.C=CN(C)C(C)=O
InChIInChI=1S/C7H11NO2.C5H9NO/c1-2-7(9)8-3-5-10-6-4-8;1-4-6(3)5(2)7/h2H,1,3-6H2;4H,1H2,2-3H3
InChIKeyFWYBQTWSFJRYED-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.64
Rot. Bonds2

About N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one

N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one (PubChem CID 141284546) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one.

Molecular Properties

Compound NameN-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one
PubChem CID141284546
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC NameN-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one
SMILESC=CC(=O)N1CCOCC1.C=CN(C)C(C)=O
InChIInChI=1S/C7H11NO2.C5H9NO/c1-2-7(9)8-3-5-10-6-4-8;1-4-6(3)5(2)7/h2H,1,3-6H2;4H,1H2,2-3H3
InChIKeyFWYBQTWSFJRYED-UHFFFAOYSA-N
XLogP0.64
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

but-2-enedioic acid;1-morpholin-4-ylprop-2-en-1-one
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N,N-dimethyl-4-prop-2-enoylpiperazine-1-carboxamide
CID 60949594
1-[(3S,4S)-3-methyl-4-(morpholine-4-carbonyl)pyrrolidin-1-yl]prop-2-en-1-one
CID 126827528
(E)-1,4-dimorpholin-4-ylbut-2-ene-1,4-dione
CID 728972
1-pyrrolidin-1-ylprop-2-en-1-one;N,N,2-trimethylprop-2-enamide
CID 70414233
N-(hydroxymethyl)prop-2-enamide;2-methylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one;prop-2-enamide
CID 174819679
1-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)ethanone
CID 10335257
1-(azetidin-1-yl)prop-2-en-1-one
CID 25230596
1-(1,4,7-trioxa-10-azacyclododec-10-yl)ethanone
CID 949153
1-(1,4,7,10,13,16,19-heptaoxa-22-azacyclotetracos-22-yl)ethanone
CID 20707611
ethane;(E)-1-morpholin-4-ylbut-2-en-1-one
CID 143019024

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one?
The IUPAC name of N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one (CID 141284546) is N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one.
What is the SMILES notation for N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one?
The canonical SMILES for N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one is C=CC(=O)N1CCOCC1.C=CN(C)C(C)=O.
What is the InChIKey of N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one?
The InChIKey is FWYBQTWSFJRYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2.C5H9NO/c1-2-7(9)8-3-5-10-6-4-8;1-4-6(3)5(2)7/h2H,1,3-6H2;4H,1H2,2-3H3.
What are the key properties of N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one?
N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one has a molecular weight of 240.30 g/mol, XLogP of 0.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-methylacetamide;1-morpholin-4-ylprop-2-en-1-one is sourced from PubChem (CID 141284546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).