ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate

C11H20N2O4 — CID 43593180

IUPACethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate
SMILESCCOC(=O)CNC(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C11H20N2O4/c1-4-16-9(14)7-12-10(15)13-5-6-17-11(2,3)8-13/h4-8H2,1-3H3,(H,12,15)
InChIKeyGTRAHLGRQQHRHV-UHFFFAOYSA-N
MW244.29 g/mol
LogP0.37
Rot. Bonds3

About ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate

ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate (PubChem CID 43593180) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate
PubChem CID43593180
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Nameethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate
SMILESCCOC(=O)CNC(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C11H20N2O4/c1-4-16-9(14)7-12-10(15)13-5-6-17-11(2,3)8-13/h4-8H2,1-3H3,(H,12,15)
InChIKeyGTRAHLGRQQHRHV-UHFFFAOYSA-N
XLogP0.37
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate?
The IUPAC name of ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate (CID 43593180) is ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate.
What is the SMILES notation for ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate?
The canonical SMILES for ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate is CCOC(=O)CNC(=O)N1CCOC(C)(C)C1.
What is the InChIKey of ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate?
The InChIKey is GTRAHLGRQQHRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-4-16-9(14)7-12-10(15)13-5-6-17-11(2,3)8-13/h4-8H2,1-3H3,(H,12,15).
What are the key properties of ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate?
ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate has a molecular weight of 244.29 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate is sourced from PubChem (CID 43593180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).