2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide

C14H25N3O4 — CID 110282985

IUPAC2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
SMILESCOCCN1CCNC(CC(=O)NCC2CCCO2)C1=O
InChIInChI=1S/C14H25N3O4/c1-20-8-6-17-5-4-15-12(14(17)19)9-13(18)16-10-11-3-2-7-21-11/h11-12,15H,2-10H2,1H3,(H,16,18)
InChIKeyUUBHMNPZPZGCIC-UHFFFAOYSA-N
MW299.37 g/mol
LogP-0.88
Rot. Bonds7

About 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide

2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide (PubChem CID 110282985) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
PubChem CID110282985
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC Name2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide
SMILESCOCCN1CCNC(CC(=O)NCC2CCCO2)C1=O
InChIInChI=1S/C14H25N3O4/c1-20-8-6-17-5-4-15-12(14(17)19)9-13(18)16-10-11-3-2-7-21-11/h11-12,15H,2-10H2,1H3,(H,16,18)
InChIKeyUUBHMNPZPZGCIC-UHFFFAOYSA-N
XLogP-0.88
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[3-oxo-4-(oxolan-2-ylmethyl)piperazin-2-yl]acetamide
CID 110282877
2-(2-methoxyethylamino)-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 119670121
N-(2-methoxyethyl)-N'-(oxolan-2-ylmethyl)propanediamide
CID 108943055
2-(2-methoxyethylamino)-N-(oxan-2-ylmethyl)acetamide
CID 79281834
2-[3-oxo-4-(oxolan-2-ylmethyl)piperazin-2-yl]-N-phenylacetamide
CID 110282899
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
N,N-diethyl-2-[3-oxo-4-(oxolan-2-ylmethyl)piperazin-2-yl]acetamide
CID 110282833
N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
CID 110696561
2-methylsulfanyl-N-(oxolan-2-ylmethyl)acetamide
CID 51109505
benzyl 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]acetate
CID 110282921
N-(oxolan-2-ylmethyl)-2-piperidin-2-ylacetamide
CID 43151298
N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 7437120

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
The IUPAC name of 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide (CID 110282985) is 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide is COCCN1CCNC(CC(=O)NCC2CCCO2)C1=O.
What is the InChIKey of 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
The InChIKey is UUBHMNPZPZGCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c1-20-8-6-17-5-4-15-12(14(17)19)9-13(18)16-10-11-3-2-7-21-11/h11-12,15H,2-10H2,1H3,(H,16,18).
What are the key properties of 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide?
2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide has a molecular weight of 299.37 g/mol, XLogP of -0.88, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N-(oxolan-2-ylmethyl)acetamide is sourced from PubChem (CID 110282985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).