2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide

C9H17N3O2 — CID 62311797

IUPAC2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCNCC1=O
InChIInChI=1S/C9H17N3O2/c1-7(2)11-8(13)6-12-4-3-10-5-9(12)14/h7,10H,3-6H2,1-2H3,(H,11,13)
InChIKeyKWJGHOXHCYAMHY-UHFFFAOYSA-N
MW199.25 g/mol
LogP-1.06
Rot. Bonds3

About 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide

2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide (PubChem CID 62311797) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide
PubChem CID62311797
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCNCC1=O
InChIInChI=1S/C9H17N3O2/c1-7(2)11-8(13)6-12-4-3-10-5-9(12)14/h7,10H,3-6H2,1-2H3,(H,11,13)
InChIKeyKWJGHOXHCYAMHY-UHFFFAOYSA-N
XLogP-1.06
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-oxopiperidin-1-yl)-N-propan-2-ylacetamide
CID 110689762
N-methyl-2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide
CID 62310011
N-(2-methylcyclopropyl)-2-(2-oxopiperazin-1-yl)acetamide
CID 119732239
methyl 2-(2-oxopiperazin-1-yl)acetate;hydrochloride
CID 54759045
N-ethyl-2-(2-oxo-1,4-diazepan-1-yl)acetamide
CID 65362324
N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride
CID 119669590
N-(3-methoxypropyl)-2-(2-oxopiperazin-1-yl)acetamide
CID 62310212
N-[(1R)-1-(1-ethylbenzimidazol-2-yl)ethyl]-2-(2-oxopiperazin-1-yl)acetamide
CID 124686566
1-[(2S)-2-hydroxypropyl]piperazin-2-one
CID 96979456
N,N-diethyl-2-(2-oxopiperazin-1-yl)acetamide
CID 62311999
N-[1-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]-2-(2-oxopiperazin-1-yl)acetamide
CID 167787666
2-(3-oxopiperazin-1-yl)-N-propan-2-ylacetamide
CID 162152546

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide (CID 62311797) is 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)CN1CCNCC1=O.
What is the InChIKey of 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide?
The InChIKey is KWJGHOXHCYAMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-7(2)11-8(13)6-12-4-3-10-5-9(12)14/h7,10H,3-6H2,1-2H3,(H,11,13).
What are the key properties of 2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide?
2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide has a molecular weight of 199.25 g/mol, XLogP of -1.06, 3 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)-N-propan-2-ylacetamide is sourced from PubChem (CID 62311797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).