2-(2-oxopiperazin-1-yl)acetamide

C6H11N3O2 — CID 45099465

IUPAC2-(2-oxopiperazin-1-yl)acetamide
SMILESNC(=O)CN1CCNCC1=O
InChIInChI=1S/C6H11N3O2/c7-5(10)4-9-2-1-8-3-6(9)11/h8H,1-4H2,(H2,7,10)
InChIKeyGTSLIQJQUYVAFZ-UHFFFAOYSA-N
MW157.17 g/mol
LogP-2.10
Rot. Bonds2

About 2-(2-oxopiperazin-1-yl)acetamide

2-(2-oxopiperazin-1-yl)acetamide (PubChem CID 45099465) has the molecular formula C6H11N3O2 and a molecular weight of 157.17 g/mol. Its IUPAC name is 2-(2-oxopiperazin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2-oxopiperazin-1-yl)acetamide
PubChem CID45099465
Molecular FormulaC6H11N3O2
Molecular Weight157.17 g/mol
Exact Mass157.09
IUPAC Name2-(2-oxopiperazin-1-yl)acetamide
SMILESNC(=O)CN1CCNCC1=O
InChIInChI=1S/C6H11N3O2/c7-5(10)4-9-2-1-8-3-6(9)11/h8H,1-4H2,(H2,7,10)
InChIKeyGTSLIQJQUYVAFZ-UHFFFAOYSA-N
XLogP-2.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 5-2.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxopiperazin-1-yl)acetamide?
The IUPAC name of 2-(2-oxopiperazin-1-yl)acetamide (CID 45099465) is 2-(2-oxopiperazin-1-yl)acetamide.
What is the SMILES notation for 2-(2-oxopiperazin-1-yl)acetamide?
The canonical SMILES for 2-(2-oxopiperazin-1-yl)acetamide is NC(=O)CN1CCNCC1=O.
What is the InChIKey of 2-(2-oxopiperazin-1-yl)acetamide?
The InChIKey is GTSLIQJQUYVAFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O2/c7-5(10)4-9-2-1-8-3-6(9)11/h8H,1-4H2,(H2,7,10).
What are the key properties of 2-(2-oxopiperazin-1-yl)acetamide?
2-(2-oxopiperazin-1-yl)acetamide has a molecular weight of 157.17 g/mol, XLogP of -2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxopiperazin-1-yl)acetamide is sourced from PubChem (CID 45099465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).