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

C11H21NO4 — CID 112603588

IUPACmethyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate
SMILESCCN(CC(=O)OC)C(=O)COC(C)(C)C
InChIInChI=1S/C11H21NO4/c1-6-12(7-10(14)15-5)9(13)8-16-11(2,3)4/h6-8H2,1-5H3
InChIKeySQKDZUIBUMDZPR-UHFFFAOYSA-N
MW231.29 g/mol
LogP0.82
Rot. Bonds5

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

methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate (PubChem CID 112603588) has the molecular formula C11H21NO4 and a molecular weight of 231.29 g/mol. Its IUPAC name is methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate.

Molecular Properties

Compound Namemethyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate
PubChem CID112603588
Molecular FormulaC11H21NO4
Molecular Weight231.29 g/mol
Exact Mass231.15
IUPAC Namemethyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate
SMILESCCN(CC(=O)OC)C(=O)COC(C)(C)C
InChIInChI=1S/C11H21NO4/c1-6-12(7-10(14)15-5)9(13)8-16-11(2,3)4/h6-8H2,1-5H3
InChIKeySQKDZUIBUMDZPR-UHFFFAOYSA-N
XLogP0.82
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetamide
CID 112604720
methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate
CID 61383689
ethyl 4-[ethyl-(2-methoxy-2-oxoethyl)amino]-4-oxobutanoate
CID 54979582
N-ethyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604773
methyl 2-[(3-chloro-2,2-dimethylpropanoyl)-ethylamino]acetate
CID 63665289
N-(3-amino-3-sulfanylidenepropyl)-N-ethyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112602684
methyl 2-[[2-(4-aminophenoxy)acetyl]-ethylamino]acetate
CID 54998119
N,N-dimethyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 12636379
methyl 2-[ethyl-[2-(2-fluorophenoxy)acetyl]amino]acetate
CID 54979366
methyl 2-[ethoxycarbonyl-(2-methoxy-2-oxoethyl)amino]acetate
CID 62953811
(2S)-2-[[ethyl-(2-methoxy-2-oxoethyl)carbamoyl]amino]-3,3-dimethylbutanoic acid
CID 54998374
methyl 2-[(2-cyano-2-methylbutanoyl)-ethylamino]acetate
CID 114291310

Frequently Asked Questions

What is the IUPAC name of methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate?
The IUPAC name of methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate (CID 112603588) is methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate.
What is the SMILES notation for methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate?
The canonical SMILES for methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate is CCN(CC(=O)OC)C(=O)COC(C)(C)C.
What is the InChIKey of methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate?
The InChIKey is SQKDZUIBUMDZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO4/c1-6-12(7-10(14)15-5)9(13)8-16-11(2,3)4/h6-8H2,1-5H3.
What are the key properties of methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate?
methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate has a molecular weight of 231.29 g/mol, XLogP of 0.82, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate is sourced from PubChem (CID 112603588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).