methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate

C11H19NO6 — CID 112690225

IUPACmethyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate
SMILESCOC(=O)CN(CC(=O)OC)C(=O)COC(C)C
InChIInChI=1S/C11H19NO6/c1-8(2)18-7-9(13)12(5-10(14)16-3)6-11(15)17-4/h8H,5-7H2,1-4H3
InChIKeyDSQUYFCDODZBBZ-UHFFFAOYSA-N
MW261.27 g/mol
LogP-0.41
Rot. Bonds7

About methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate

methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate (PubChem CID 112690225) has the molecular formula C11H19NO6 and a molecular weight of 261.27 g/mol. Its IUPAC name is methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate
PubChem CID112690225
Molecular FormulaC11H19NO6
Molecular Weight261.27 g/mol
Exact Mass261.12
IUPAC Namemethyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate
SMILESCOC(=O)CN(CC(=O)OC)C(=O)COC(C)C
InChIInChI=1S/C11H19NO6/c1-8(2)18-7-9(13)12(5-10(14)16-3)6-11(15)17-4/h8H,5-7H2,1-4H3
InChIKeyDSQUYFCDODZBBZ-UHFFFAOYSA-N
XLogP-0.41
TPSA82.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 5-0.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate?
The IUPAC name of methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate (CID 112690225) is methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate.
What is the SMILES notation for methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate?
The canonical SMILES for methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate is COC(=O)CN(CC(=O)OC)C(=O)COC(C)C.
What is the InChIKey of methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate?
The InChIKey is DSQUYFCDODZBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO6/c1-8(2)18-7-9(13)12(5-10(14)16-3)6-11(15)17-4/h8H,5-7H2,1-4H3.
What are the key properties of methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate?
methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate has a molecular weight of 261.27 g/mol, XLogP of -0.41, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-methoxy-2-oxoethyl)-(2-propan-2-yloxyacetyl)amino]acetate is sourced from PubChem (CID 112690225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).