2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide

C11H22N2O3 — CID 113159868

IUPAC2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide
SMILESCOCCN(CC(=O)NC(C)(C)C)C(C)=O
InChIInChI=1S/C11H22N2O3/c1-9(14)13(6-7-16-5)8-10(15)12-11(2,3)4/h6-8H2,1-5H3,(H,12,15)
InChIKeyHQZQWAZOKDXTBD-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.40
Rot. Bonds5

About 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide

2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide (PubChem CID 113159868) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide.

Molecular Properties

Compound Name2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide
PubChem CID113159868
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide
SMILESCOCCN(CC(=O)NC(C)(C)C)C(C)=O
InChIInChI=1S/C11H22N2O3/c1-9(14)13(6-7-16-5)8-10(15)12-11(2,3)4/h6-8H2,1-5H3,(H,12,15)
InChIKeyHQZQWAZOKDXTBD-UHFFFAOYSA-N
XLogP0.40
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 ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide?
The IUPAC name of 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide (CID 113159868) is 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide.
What is the SMILES notation for 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide?
The canonical SMILES for 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide is COCCN(CC(=O)NC(C)(C)C)C(C)=O.
What is the InChIKey of 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide?
The InChIKey is HQZQWAZOKDXTBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-9(14)13(6-7-16-5)8-10(15)12-11(2,3)4/h6-8H2,1-5H3,(H,12,15).
What are the key properties of 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide?
2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide has a molecular weight of 230.31 g/mol, XLogP of 0.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(2-methoxyethyl)amino]-N-tert-butylacetamide is sourced from PubChem (CID 113159868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).