2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide

C9H17N3O3 — CID 103810783

IUPAC2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide
SMILESCN1CCC(NC(=O)COCCN)C1=O
InChIInChI=1S/C9H17N3O3/c1-12-4-2-7(9(12)14)11-8(13)6-15-5-3-10/h7H,2-6,10H2,1H3,(H,11,13)
InChIKeyWDFDTOLUZIGCJA-UHFFFAOYSA-N
MW215.25 g/mol
LogP-1.69
Rot. Bonds5

About 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide

2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide (PubChem CID 103810783) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide
PubChem CID103810783
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide
SMILESCN1CCC(NC(=O)COCCN)C1=O
InChIInChI=1S/C9H17N3O3/c1-12-4-2-7(9(12)14)11-8(13)6-15-5-3-10/h7H,2-6,10H2,1H3,(H,11,13)
InChIKeyWDFDTOLUZIGCJA-UHFFFAOYSA-N
XLogP-1.69
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-1.69
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-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide (CID 103810783) is 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide is CN1CCC(NC(=O)COCCN)C1=O.
What is the InChIKey of 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide?
The InChIKey is WDFDTOLUZIGCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-12-4-2-7(9(12)14)11-8(13)6-15-5-3-10/h7H,2-6,10H2,1H3,(H,11,13).
What are the key properties of 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide?
2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide has a molecular weight of 215.25 g/mol, XLogP of -1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide is sourced from PubChem (CID 103810783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).