(3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one

C11H18N2O2 — CID 146270393

IUPAC(3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one
SMILESC=CN1CC(COC)N(C)C(=O)/C1=C/C
InChIInChI=1S/C11H18N2O2/c1-5-10-11(14)12(3)9(8-15-4)7-13(10)6-2/h5-6,9H,2,7-8H2,1,3-4H3/b10-5-
InChIKeyQCNCMYQXXVBONH-YHYXMXQVSA-N
MW210.28 g/mol
LogP0.82
Rot. Bonds3

About (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one

(3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one (PubChem CID 146270393) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one.

Molecular Properties

Compound Name(3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one
PubChem CID146270393
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name(3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one
SMILESC=CN1CC(COC)N(C)C(=O)/C1=C/C
InChIInChI=1S/C11H18N2O2/c1-5-10-11(14)12(3)9(8-15-4)7-13(10)6-2/h5-6,9H,2,7-8H2,1,3-4H3/b10-5-
InChIKeyQCNCMYQXXVBONH-YHYXMXQVSA-N
XLogP0.82
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Methyl-5-morpholin-4-yl-2,3-dihydropyridin-6-one
CID 21137416
(E)-2-isocyano-1-morpholin-4-ylbut-2-en-1-one
CID 59812210
(Z)-4-amino-2-(methylamino)-1-[(3R)-3-(methylaminomethyl)morpholin-4-yl]but-2-en-1-one
CID 130179833
1-Methyl-3-morpholin-4-ylpyridin-2-one
CID 140320787
1-Ethyl-3-morpholin-4-ylpyridin-2-one
CID 150124309
1-[(3S)-4-(2-methoxyethyl)-3-methylpiperazin-1-yl]prop-2-en-1-one
CID 176676880
5-Amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
CID 55118344
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)acetamide
CID 62814608
2-(5-amino-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)-N-methylacetamide
CID 62814966
5-Amino-1-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
CID 62815126
2-(5-amino-2-oxo-1-pyridinyl)-N-butan-2-yl-N-(2-methoxyethyl)acetamide
CID 62815148
2-(5-amino-2-oxo-1-pyridinyl)-N-ethyl-N-(1-methoxypropan-2-yl)acetamide
CID 62816526

Frequently Asked Questions

What is the IUPAC name of (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one?
The IUPAC name of (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one (CID 146270393) is (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one.
What is the SMILES notation for (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one?
The canonical SMILES for (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one is C=CN1CC(COC)N(C)C(=O)/C1=C/C.
What is the InChIKey of (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one?
The InChIKey is QCNCMYQXXVBONH-YHYXMXQVSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-5-10-11(14)12(3)9(8-15-4)7-13(10)6-2/h5-6,9H,2,7-8H2,1,3-4H3/b10-5-.
What are the key properties of (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one?
(3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one has a molecular weight of 210.28 g/mol, XLogP of 0.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-4-ethenyl-3-ethylidene-6-(methoxymethyl)-1-methylpiperazin-2-one is sourced from PubChem (CID 146270393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).