2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate

C8H14N2O3 — CID 15746399

IUPAC2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate
SMILESCC(=O)OCCN1CCN(C)C1=O
InChIInChI=1S/C8H14N2O3/c1-7(11)13-6-5-10-4-3-9(2)8(10)12/h3-6H2,1-2H3
InChIKeyICSHCPATZANHRG-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.08
Rot. Bonds3

About 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate

2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate (PubChem CID 15746399) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate.

Molecular Properties

Compound Name2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate
PubChem CID15746399
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate
SMILESCC(=O)OCCN1CCN(C)C1=O
InChIInChI=1S/C8H14N2O3/c1-7(11)13-6-5-10-4-3-9(2)8(10)12/h3-6H2,1-2H3
InChIKeyICSHCPATZANHRG-UHFFFAOYSA-N
XLogP-0.08
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Acetic acid 5-acetoxy-1,3-diacetyl-2-oxo-imidazolidin-4-yl ester
CID 652321
Ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,4,5-trioxoimidazolidin-1-yl]acetate
CID 90480645
1,3-Dimethyl-2-oxoimidazolidine-4,5-diyl diacetate
CID 4282473
1,3-Diacetylimidazolidine-4,5-diyl diacetate
CID 5253296
1,3-Diethyl-2-oxoimidazolidine-4,5-diyl diacetate
CID 5113021
Methyl 1,3-diacetylimidazolidine-2-carboxylate
CID 102113005
Ethyl 2-(3-carbamoyl-2,5-dioxoimidazolidin-1-yl)acetate
CID 155490233
Ethyl 2-fluoro-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetate
CID 81297727
Ethyl 2-fluoro-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetate
CID 81297876
Ethyl 2-fluoro-2-(3-methyl-2-oxoimidazolidin-1-yl)acetate
CID 81298145
Ethyl (3-ethyl-4-oxo-2-thioxo-1-imidazolidinyl)acetate
CID 3661232
5-Acetyloxy-1,3-diformylimidazolidin-4-yl acetate
CID 3624057

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate?
The IUPAC name of 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate (CID 15746399) is 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate.
What is the SMILES notation for 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate?
The canonical SMILES for 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate is CC(=O)OCCN1CCN(C)C1=O.
What is the InChIKey of 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate?
The InChIKey is ICSHCPATZANHRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-7(11)13-6-5-10-4-3-9(2)8(10)12/h3-6H2,1-2H3.
What are the key properties of 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate?
2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate has a molecular weight of 186.21 g/mol, XLogP of -0.08, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl acetate is sourced from PubChem (CID 15746399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).