N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide

C14H25N5O3 — CID 50961791

IUPACN-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide
SMILESCC(C)N1CCNC(=O)C1CC(=O)NCCN1CCNC1=O
InChIInChI=1S/C14H25N5O3/c1-10(2)19-8-5-16-13(21)11(19)9-12(20)15-3-6-18-7-4-17-14(18)22/h10-11H,3-9H2,1-2H3,(H,15,20)(H,16,21)(H,17,22)
InChIKeyXRUNCBRYLCPUFE-UHFFFAOYSA-N
MW311.39 g/mol
LogP-1.27
Rot. Bonds6

About N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide

N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide (PubChem CID 50961791) has the molecular formula C14H25N5O3 and a molecular weight of 311.39 g/mol. Its IUPAC name is N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide
PubChem CID50961791
Molecular FormulaC14H25N5O3
Molecular Weight311.39 g/mol
Exact Mass311.20
IUPAC NameN-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide
SMILESCC(C)N1CCNC(=O)C1CC(=O)NCCN1CCNC1=O
InChIInChI=1S/C14H25N5O3/c1-10(2)19-8-5-16-13(21)11(19)9-12(20)15-3-6-18-7-4-17-14(18)22/h10-11H,3-9H2,1-2H3,(H,15,20)(H,16,21)(H,17,22)
InChIKeyXRUNCBRYLCPUFE-UHFFFAOYSA-N
XLogP-1.27
TPSA93.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide?
The IUPAC name of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide (CID 50961791) is N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide.
What is the SMILES notation for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide?
The canonical SMILES for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide is CC(C)N1CCNC(=O)C1CC(=O)NCCN1CCNC1=O.
What is the InChIKey of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide?
The InChIKey is XRUNCBRYLCPUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O3/c1-10(2)19-8-5-16-13(21)11(19)9-12(20)15-3-6-18-7-4-17-14(18)22/h10-11H,3-9H2,1-2H3,(H,15,20)(H,16,21)(H,17,22).
What are the key properties of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide?
N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide has a molecular weight of 311.39 g/mol, XLogP of -1.27, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(3-oxo-1-propan-2-ylpiperazin-2-yl)acetamide is sourced from PubChem (CID 50961791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).