1-ethyl-2,3-dimethylimidazolidine

C7H16N2 — CID 21478047

IUPAC1-ethyl-2,3-dimethylimidazolidine
SMILESCCN1CCN(C)C1C
InChIInChI=1S/C7H16N2/c1-4-9-6-5-8(3)7(9)2/h7H,4-6H2,1-3H3
InChIKeyJIFXKZJGKSXAGZ-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.60
Rot. Bonds1

About 1-ethyl-2,3-dimethylimidazolidine

1-ethyl-2,3-dimethylimidazolidine (PubChem CID 21478047) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-ethyl-2,3-dimethylimidazolidine.

Molecular Properties

Compound Name1-ethyl-2,3-dimethylimidazolidine
PubChem CID21478047
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1-ethyl-2,3-dimethylimidazolidine
SMILESCCN1CCN(C)C1C
InChIInChI=1S/C7H16N2/c1-4-9-6-5-8(3)7(9)2/h7H,4-6H2,1-3H3
InChIKeyJIFXKZJGKSXAGZ-UHFFFAOYSA-N
XLogP0.60
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3-dimethylimidazolidine?
The IUPAC name of 1-ethyl-2,3-dimethylimidazolidine (CID 21478047) is 1-ethyl-2,3-dimethylimidazolidine.
What is the SMILES notation for 1-ethyl-2,3-dimethylimidazolidine?
The canonical SMILES for 1-ethyl-2,3-dimethylimidazolidine is CCN1CCN(C)C1C.
What is the InChIKey of 1-ethyl-2,3-dimethylimidazolidine?
The InChIKey is JIFXKZJGKSXAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-4-9-6-5-8(3)7(9)2/h7H,4-6H2,1-3H3.
What are the key properties of 1-ethyl-2,3-dimethylimidazolidine?
1-ethyl-2,3-dimethylimidazolidine has a molecular weight of 128.22 g/mol, XLogP of 0.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3-dimethylimidazolidine is sourced from PubChem (CID 21478047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).