ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate

C11H22N2O3 — CID 63960119

IUPACethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate
SMILESCCOC(=O)CNC(=O)N(C)C(C)(C)CC
InChIInChI=1S/C11H22N2O3/c1-6-11(3,4)13(5)10(15)12-8-9(14)16-7-2/h6-8H2,1-5H3,(H,12,15)
InChIKeyFFFPHRQENWZCTK-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.38
Rot. Bonds5

About ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate

ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate (PubChem CID 63960119) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate
PubChem CID63960119
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Nameethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate
SMILESCCOC(=O)CNC(=O)N(C)C(C)(C)CC
InChIInChI=1S/C11H22N2O3/c1-6-11(3,4)13(5)10(15)12-8-9(14)16-7-2/h6-8H2,1-5H3,(H,12,15)
InChIKeyFFFPHRQENWZCTK-UHFFFAOYSA-N
XLogP1.38
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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ethyl 2-[[2-methylpropyl(pentan-3-yl)carbamoyl]amino]acetate
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(2-ethoxy-2-oxoethyl)carbamothioic S-acid
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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate?
The IUPAC name of ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate (CID 63960119) is ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate?
The canonical SMILES for ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate is CCOC(=O)CNC(=O)N(C)C(C)(C)CC.
What is the InChIKey of ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate?
The InChIKey is FFFPHRQENWZCTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-6-11(3,4)13(5)10(15)12-8-9(14)16-7-2/h6-8H2,1-5H3,(H,12,15).
What are the key properties of ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate?
ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate has a molecular weight of 230.31 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate is sourced from PubChem (CID 63960119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).