N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide

C10H17N3O3 — CID 63605846

IUPACN-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCNC(=O)C1(C)C
InChIInChI=1S/C10H17N3O3/c1-7(14)12-6-8(15)13-5-4-11-9(16)10(13,2)3/h4-6H2,1-3H3,(H,11,16)(H,12,14)
InChIKeyCMOALHDOBFFBTM-UHFFFAOYSA-N
MW227.26 g/mol
LogP-1.14
Rot. Bonds2

About N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide

N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide (PubChem CID 63605846) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide
PubChem CID63605846
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC NameN-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCNC(=O)C1(C)C
InChIInChI=1S/C10H17N3O3/c1-7(14)12-6-8(15)13-5-4-11-9(16)10(13,2)3/h4-6H2,1-3H3,(H,11,16)(H,12,14)
InChIKeyCMOALHDOBFFBTM-UHFFFAOYSA-N
XLogP-1.14
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-1.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide?
The IUPAC name of N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide (CID 63605846) is N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide.
What is the SMILES notation for N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide?
The canonical SMILES for N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCNC(=O)C1(C)C.
What is the InChIKey of N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide?
The InChIKey is CMOALHDOBFFBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-7(14)12-6-8(15)13-5-4-11-9(16)10(13,2)3/h4-6H2,1-3H3,(H,11,16)(H,12,14).
What are the key properties of N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide?
N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide has a molecular weight of 227.26 g/mol, XLogP of -1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]acetamide is sourced from PubChem (CID 63605846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).