2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide

C8H16N2O2 — CID 114617027

IUPAC2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CNC(=O)COCCN
InChIInChI=1S/C8H16N2O2/c1-7(2)5-10-8(11)6-12-4-3-9/h1,3-6,9H2,2H3,(H,10,11)
InChIKeyXVEDJXUJGKYYED-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.35
Rot. Bonds6

About 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide

2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide (PubChem CID 114617027) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide
PubChem CID114617027
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CNC(=O)COCCN
InChIInChI=1S/C8H16N2O2/c1-7(2)5-10-8(11)6-12-4-3-9/h1,3-6,9H2,2H3,(H,10,11)
InChIKeyXVEDJXUJGKYYED-UHFFFAOYSA-N
XLogP-0.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide (CID 114617027) is 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide is C=C(C)CNC(=O)COCCN.
What is the InChIKey of 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is XVEDJXUJGKYYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-7(2)5-10-8(11)6-12-4-3-9/h1,3-6,9H2,2H3,(H,10,11).
What are the key properties of 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide?
2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 172.23 g/mol, XLogP of -0.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 114617027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).