2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide

C8H15N3O2 — CID 20544069

IUPAC2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide
SMILESNCCC1CCN(CC(N)=O)C1=O
InChIInChI=1S/C8H15N3O2/c9-3-1-6-2-4-11(8(6)13)5-7(10)12/h6H,1-5,9H2,(H2,10,12)
InChIKeyNSKNSULZPBQXTJ-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.33
Rot. Bonds4

About 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide

2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide (PubChem CID 20544069) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide
PubChem CID20544069
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide
SMILESNCCC1CCN(CC(N)=O)C1=O
InChIInChI=1S/C8H15N3O2/c9-3-1-6-2-4-11(8(6)13)5-7(10)12/h6H,1-5,9H2,(H2,10,12)
InChIKeyNSKNSULZPBQXTJ-UHFFFAOYSA-N
XLogP-1.33
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide?
The IUPAC name of 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide (CID 20544069) is 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide.
What is the SMILES notation for 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide?
The canonical SMILES for 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide is NCCC1CCN(CC(N)=O)C1=O.
What is the InChIKey of 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide?
The InChIKey is NSKNSULZPBQXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c9-3-1-6-2-4-11(8(6)13)5-7(10)12/h6H,1-5,9H2,(H2,10,12).
What are the key properties of 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide?
2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide has a molecular weight of 185.23 g/mol, XLogP of -1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-aminoethyl)-2-oxopyrrolidin-1-yl]acetamide is sourced from PubChem (CID 20544069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).