1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride

C7H17FN2 — CID 67177762

IUPAC1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride
SMILESCC[NH+]1CCN(C)C1C.[F-]
InChIInChI=1S/C7H16N2.FH/c1-4-9-6-5-8(3)7(9)2;/h7H,4-6H2,1-3H3;1H
InChIKeyAMUAFBXGWJBAKD-UHFFFAOYSA-N
MW148.23 g/mol
LogP-3.81
Rot. Bonds1

About 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride

1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride (PubChem CID 67177762) has the molecular formula C7H17FN2 and a molecular weight of 148.23 g/mol. Its IUPAC name is 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride.

Molecular Properties

Compound Name1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride
PubChem CID67177762
Molecular FormulaC7H17FN2
Molecular Weight148.23 g/mol
Exact Mass148.14
IUPAC Name1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride
SMILESCC[NH+]1CCN(C)C1C.[F-]
InChIInChI=1S/C7H16N2.FH/c1-4-9-6-5-8(3)7(9)2;/h7H,4-6H2,1-3H3;1H
InChIKeyAMUAFBXGWJBAKD-UHFFFAOYSA-N
XLogP-3.81
TPSA7.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 5-3.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2,3-trimethyl-1,3-diazinan-1-ium tetrafluoroborate
CID 87115116
1,2,3-trimethylimidazolidin-1-ium phenoxide
CID 139681265
tridecakis(4-ethyl-1,2,3-trimethylimidazolidin-1-ium);tetraborate;fluoride
CID 139844473
1,2-dimethyl-3-propylimidazolidin-1-ium tetrafluoroborate
CID 141103031
1,2,3,4-tetramethylpiperazine
CID 66583347
(2S)-1,2,3-trimethylpyrrolidine
CID 142283455
1-ethyl-2-propylpiperidin-1-ium fluoride
CID 171570809
1-ethyl-2,3-dimethylimidazolidine;hydrochloride
CID 174740578
(1,3-dimethylpyrrolidin-2-yl)methanamine
CID 58841122
4-propyl-1,4-diazabicyclo[3.1.0]hexane
CID 89356558
2-fluoro-1,3-dimethylimidazolidin-1-ium;hexane-1-sulfonate
CID 87665881
(1,2-dimethylpyrrolidin-3-yl)methanol;dihydrochloride
CID 142403583

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride?
The IUPAC name of 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride (CID 67177762) is 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride.
What is the SMILES notation for 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride?
The canonical SMILES for 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride is CC[NH+]1CCN(C)C1C.[F-].
What is the InChIKey of 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride?
The InChIKey is AMUAFBXGWJBAKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.FH/c1-4-9-6-5-8(3)7(9)2;/h7H,4-6H2,1-3H3;1H.
What are the key properties of 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride?
1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride has a molecular weight of 148.23 g/mol, XLogP of -3.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3-dimethylimidazolidin-1-ium fluoride is sourced from PubChem (CID 67177762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).