2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide

C11H21N3O3 — CID 112701223

IUPAC2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
SMILESCOC(C)C(=O)N(C)CC(=O)N1CCNCC1
InChIInChI=1S/C11H21N3O3/c1-9(17-3)11(16)13(2)8-10(15)14-6-4-12-5-7-14/h9,12H,4-8H2,1-3H3
InChIKeyJMCLBCCMGUYPLE-UHFFFAOYSA-N
MW243.31 g/mol
LogP-1.09
Rot. Bonds4

About 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide

2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide (PubChem CID 112701223) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
PubChem CID112701223
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
SMILESCOC(C)C(=O)N(C)CC(=O)N1CCNCC1
InChIInChI=1S/C11H21N3O3/c1-9(17-3)11(16)13(2)8-10(15)14-6-4-12-5-7-14/h9,12H,4-8H2,1-3H3
InChIKeyJMCLBCCMGUYPLE-UHFFFAOYSA-N
XLogP-1.09
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The IUPAC name of 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide (CID 112701223) is 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide.
What is the SMILES notation for 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The canonical SMILES for 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide is COC(C)C(=O)N(C)CC(=O)N1CCNCC1.
What is the InChIKey of 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The InChIKey is JMCLBCCMGUYPLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-9(17-3)11(16)13(2)8-10(15)14-6-4-12-5-7-14/h9,12H,4-8H2,1-3H3.
What are the key properties of 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide has a molecular weight of 243.31 g/mol, XLogP of -1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide is sourced from PubChem (CID 112701223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).