N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide

C12H23N3O2 — CID 172611657

IUPACN-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide
SMILESCCCC1NCCN(CC(=O)N(C)CC)C1=O
InChIInChI=1S/C12H23N3O2/c1-4-6-10-12(17)15(8-7-13-10)9-11(16)14(3)5-2/h10,13H,4-9H2,1-3H3
InChIKeySNFSVEVVSQSIMC-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.07
Rot. Bonds5

About N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide

N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide (PubChem CID 172611657) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide
PubChem CID172611657
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide
SMILESCCCC1NCCN(CC(=O)N(C)CC)C1=O
InChIInChI=1S/C12H23N3O2/c1-4-6-10-12(17)15(8-7-13-10)9-11(16)14(3)5-2/h10,13H,4-9H2,1-3H3
InChIKeySNFSVEVVSQSIMC-UHFFFAOYSA-N
XLogP0.07
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide?
The IUPAC name of N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide (CID 172611657) is N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide is CCCC1NCCN(CC(=O)N(C)CC)C1=O.
What is the InChIKey of N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide?
The InChIKey is SNFSVEVVSQSIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-6-10-12(17)15(8-7-13-10)9-11(16)14(3)5-2/h10,13H,4-9H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide?
N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(2-oxo-3-propylpiperazin-1-yl)acetamide is sourced from PubChem (CID 172611657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).