ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate

C10H19NO4 — CID 10921941

IUPACethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate
SMILESCCOC(=O)CNCC(=O)OC(C)(C)C
InChIInChI=1S/C10H19NO4/c1-5-14-8(12)6-11-7-9(13)15-10(2,3)4/h11H,5-7H2,1-4H3
InChIKeyYULHHTGJTXUWQI-UHFFFAOYSA-N
MW217.26 g/mol
LogP0.48
Rot. Bonds5

About ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate

ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate (PubChem CID 10921941) has the molecular formula C10H19NO4 and a molecular weight of 217.26 g/mol. Its IUPAC name is ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate
PubChem CID10921941
Molecular FormulaC10H19NO4
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC Nameethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate
SMILESCCOC(=O)CNCC(=O)OC(C)(C)C
InChIInChI=1S/C10H19NO4/c1-5-14-8(12)6-11-7-9(13)15-10(2,3)4/h11H,5-7H2,1-4H3
InChIKeyYULHHTGJTXUWQI-UHFFFAOYSA-N
XLogP0.48
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Diethyl iminodiacetate
CID 80502
DI-T-Butyl iminodiacetate
CID 4393691
Tert-butyl 2-(methylamino)acetate
CID 5069406
Sarcosine t-butyl ester hydrochloride
CID 11252350
Methyl 3-((2-(tert-butoxy)-2-oxoethyl)amino)propanoate
CID 14845245
Ethyl 2-(tert-butylamino)acetate
CID 2777441
Ethyl 2-(isobutylamino)acetate
CID 10877410
Tert-butyl 2-[(2-hydroxyethyl)amino]acetate
CID 11062917
Tert-butyl 2-((propan-2-yl)amino)acetate
CID 11469352
Tert-butyl 2-((2-methoxyethyl)amino)acetate
CID 18925475
Methyl 2-((2-(tert-butoxy)-2-oxoethyl)amino)acetate
CID 21643695
Tert-butyl 2-[(2,2-dimethylpropyl)amino]acetate
CID 23102852

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate?
The IUPAC name of ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate (CID 10921941) is ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate?
The canonical SMILES for ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate is CCOC(=O)CNCC(=O)OC(C)(C)C.
What is the InChIKey of ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate?
The InChIKey is YULHHTGJTXUWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4/c1-5-14-8(12)6-11-7-9(13)15-10(2,3)4/h11H,5-7H2,1-4H3.
What are the key properties of ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate?
ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate has a molecular weight of 217.26 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate is sourced from PubChem (CID 10921941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).