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

C10H19N3O2 — CID 43603133

IUPACN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
SMILESCCC(=O)N(C)CC(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O2/c1-3-9(14)12(2)8-10(15)13-6-4-11-5-7-13/h11H,3-8H2,1-2H3
InChIKeyVZISEHJNPLGVEM-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.71
Rot. Bonds3

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

N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide (PubChem CID 43603133) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide.

Molecular Properties

Compound NameN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
PubChem CID43603133
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC NameN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
SMILESCCC(=O)N(C)CC(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O2/c1-3-9(14)12(2)8-10(15)13-6-4-11-5-7-13/h11H,3-8H2,1-2H3
InChIKeyVZISEHJNPLGVEM-UHFFFAOYSA-N
XLogP-0.71
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The IUPAC name of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide (CID 43603133) is N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide.
What is the SMILES notation for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The canonical SMILES for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide is CCC(=O)N(C)CC(=O)N1CCNCC1.
What is the InChIKey of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
The InChIKey is VZISEHJNPLGVEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-3-9(14)12(2)8-10(15)13-6-4-11-5-7-13/h11H,3-8H2,1-2H3.
What are the key properties of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide?
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide has a molecular weight of 213.28 g/mol, XLogP of -0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide is sourced from PubChem (CID 43603133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).