1-(2,3-dimethylimidazolidin-1-yl)ethanone

C7H14N2O — CID 24805336

IUPAC1-(2,3-dimethylimidazolidin-1-yl)ethanone
SMILESCC(=O)N1CCN(C)C1C
InChIInChI=1S/C7H14N2O/c1-6-8(3)4-5-9(6)7(2)10/h6H,4-5H2,1-3H3
InChIKeyNSUNHWZIJRMOKM-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.13
Rot. Bonds

About 1-(2,3-dimethylimidazolidin-1-yl)ethanone

1-(2,3-dimethylimidazolidin-1-yl)ethanone (PubChem CID 24805336) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-(2,3-dimethylimidazolidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(2,3-dimethylimidazolidin-1-yl)ethanone
PubChem CID24805336
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-(2,3-dimethylimidazolidin-1-yl)ethanone
SMILESCC(=O)N1CCN(C)C1C
InChIInChI=1S/C7H14N2O/c1-6-8(3)4-5-9(6)7(2)10/h6H,4-5H2,1-3H3
InChIKeyNSUNHWZIJRMOKM-UHFFFAOYSA-N
XLogP0.13
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylimidazolidin-1-yl)ethanone?
The IUPAC name of 1-(2,3-dimethylimidazolidin-1-yl)ethanone (CID 24805336) is 1-(2,3-dimethylimidazolidin-1-yl)ethanone.
What is the SMILES notation for 1-(2,3-dimethylimidazolidin-1-yl)ethanone?
The canonical SMILES for 1-(2,3-dimethylimidazolidin-1-yl)ethanone is CC(=O)N1CCN(C)C1C.
What is the InChIKey of 1-(2,3-dimethylimidazolidin-1-yl)ethanone?
The InChIKey is NSUNHWZIJRMOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-6-8(3)4-5-9(6)7(2)10/h6H,4-5H2,1-3H3.
What are the key properties of 1-(2,3-dimethylimidazolidin-1-yl)ethanone?
1-(2,3-dimethylimidazolidin-1-yl)ethanone has a molecular weight of 142.20 g/mol, XLogP of 0.13, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylimidazolidin-1-yl)ethanone is sourced from PubChem (CID 24805336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).