2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide

C11H20N2O4 — CID 122467379

IUPAC2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide
SMILESC=C(C)C(=O)NCCOCCOCC(=O)NC
InChIInChI=1S/C11H20N2O4/c1-9(2)11(15)13-4-5-16-6-7-17-8-10(14)12-3/h1,4-8H2,2-3H3,(H,12,14)(H,13,15)
InChIKeyDZYAMAHHEROFSZ-UHFFFAOYSA-N
MW244.29 g/mol
LogP-0.54
Rot. Bonds9

About 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide

2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide (PubChem CID 122467379) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide.

Molecular Properties

Compound Name2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide
PubChem CID122467379
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Name2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide
SMILESC=C(C)C(=O)NCCOCCOCC(=O)NC
InChIInChI=1S/C11H20N2O4/c1-9(2)11(15)13-4-5-16-6-7-17-8-10(14)12-3/h1,4-8H2,2-3H3,(H,12,14)(H,13,15)
InChIKeyDZYAMAHHEROFSZ-UHFFFAOYSA-N
XLogP-0.54
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide?
The IUPAC name of 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide (CID 122467379) is 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide.
What is the SMILES notation for 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide?
The canonical SMILES for 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide is C=C(C)C(=O)NCCOCCOCC(=O)NC.
What is the InChIKey of 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide?
The InChIKey is DZYAMAHHEROFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-9(2)11(15)13-4-5-16-6-7-17-8-10(14)12-3/h1,4-8H2,2-3H3,(H,12,14)(H,13,15).
What are the key properties of 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide?
2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide has a molecular weight of 244.29 g/mol, XLogP of -0.54, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-[2-(methylamino)-2-oxoethoxy]ethoxy]ethyl]prop-2-enamide is sourced from PubChem (CID 122467379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).