2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide

C13H28N2O3 — CID 144781193

IUPAC2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide
SMILESCC(C)CC(C)(C)NC(=O)COCCOCCN
InChIInChI=1S/C13H28N2O3/c1-11(2)9-13(3,4)15-12(16)10-18-8-7-17-6-5-14/h11H,5-10,14H2,1-4H3,(H,15,16)
InChIKeyQYHHAWIRRXAKNY-UHFFFAOYSA-N
MW260.38 g/mol
LogP0.92
Rot. Bonds10

About 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide

2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide (PubChem CID 144781193) has the molecular formula C13H28N2O3 and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide
PubChem CID144781193
Molecular FormulaC13H28N2O3
Molecular Weight260.38 g/mol
Exact Mass260.21
IUPAC Name2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide
SMILESCC(C)CC(C)(C)NC(=O)COCCOCCN
InChIInChI=1S/C13H28N2O3/c1-11(2)9-13(3,4)15-12(16)10-18-8-7-17-6-5-14/h11H,5-10,14H2,1-4H3,(H,15,16)
InChIKeyQYHHAWIRRXAKNY-UHFFFAOYSA-N
XLogP0.92
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide?
The IUPAC name of 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide (CID 144781193) is 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide.
What is the SMILES notation for 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide?
The canonical SMILES for 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide is CC(C)CC(C)(C)NC(=O)COCCOCCN.
What is the InChIKey of 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide?
The InChIKey is QYHHAWIRRXAKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O3/c1-11(2)9-13(3,4)15-12(16)10-18-8-7-17-6-5-14/h11H,5-10,14H2,1-4H3,(H,15,16).
What are the key properties of 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide?
2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 0.92, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethoxy)ethoxy]-N-(2,4-dimethylpentan-2-yl)acetamide is sourced from PubChem (CID 144781193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).