N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide

C11H20N4O3 — CID 30758749

IUPACN,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide
SMILESCN(CC(=O)N(C)C)CC(=O)N1CCNC(=O)C1
InChIInChI=1S/C11H20N4O3/c1-13(2)10(17)7-14(3)8-11(18)15-5-4-12-9(16)6-15/h4-8H2,1-3H3,(H,12,16)
InChIKeyWMVCCKFIKKRXRL-UHFFFAOYSA-N
MW256.31 g/mol
LogP-2.04
Rot. Bonds4

About N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide

N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide (PubChem CID 30758749) has the molecular formula C11H20N4O3 and a molecular weight of 256.31 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide
PubChem CID30758749
Molecular FormulaC11H20N4O3
Molecular Weight256.31 g/mol
Exact Mass256.15
IUPAC NameN,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide
SMILESCN(CC(=O)N(C)C)CC(=O)N1CCNC(=O)C1
InChIInChI=1S/C11H20N4O3/c1-13(2)10(17)7-14(3)8-11(18)15-5-4-12-9(16)6-15/h4-8H2,1-3H3,(H,12,16)
InChIKeyWMVCCKFIKKRXRL-UHFFFAOYSA-N
XLogP-2.04
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 5-2.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide?
The IUPAC name of N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide (CID 30758749) is N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide is CN(CC(=O)N(C)C)CC(=O)N1CCNC(=O)C1.
What is the InChIKey of N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide?
The InChIKey is WMVCCKFIKKRXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3/c1-13(2)10(17)7-14(3)8-11(18)15-5-4-12-9(16)6-15/h4-8H2,1-3H3,(H,12,16).
What are the key properties of N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide?
N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide has a molecular weight of 256.31 g/mol, XLogP of -2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide is sourced from PubChem (CID 30758749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).