[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium

C6H12FN2+ — CID 134895746

IUPAC[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium
SMILESCN/C=C(\F)C=[N+](C)C
InChIInChI=1S/C6H11FN2/c1-8-4-6(7)5-9(2)3/h4-5H,1-3H3/p+1
InChIKeyYXMPSOFZEMYRGG-UHFFFAOYSA-O
MW131.17 g/mol
LogP0.36
Rot. Bonds2

About [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium

[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium (PubChem CID 134895746) has the molecular formula C6H12FN2+ and a molecular weight of 131.17 g/mol. Its IUPAC name is [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium.

Molecular Properties

Compound Name[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium
PubChem CID134895746
Molecular FormulaC6H12FN2+
Molecular Weight131.17 g/mol
Exact Mass131.10
IUPAC Name[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium
SMILESCN/C=C(\F)C=[N+](C)C
InChIInChI=1S/C6H11FN2/c1-8-4-6(7)5-9(2)3/h4-5H,1-3H3/p+1
InChIKeyYXMPSOFZEMYRGG-UHFFFAOYSA-O
XLogP0.36
TPSA15.04 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.17
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium 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

(E)-2-fluoro-3-methyliminoprop-1-en-1-amine
CID 87688897
dimethyl-[(Z)-3-(methylamino)-2-(trifluoromethyl)prop-2-enylidene]azanium
CID 144448385
2-Fluoro-3-methyliminoprop-1-en-1-amine
CID 147359228
(Z)-3,3,3-trifluoro-N-methyl-2-(methyliminomethyl)prop-1-en-1-amine
CID 147780972
(E)-2-fluoro-N-methyl-3-methyliminoprop-1-en-1-amine
CID 166751069
[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium tetrafluoroborate
CID 134895745
[(Z)-3-(dimethylamino)-2-fluoroprop-2-enylidene]-dimethylazanium
CID 72212370
5-Fluoro-2-methyl-1,2-dihydropyrimidine
CID 141810282
(E)-N-ethyl-2-fluoro-3-imino-N-methylprop-1-en-1-amine
CID 142441986
[3-(Dimethylamino)-2-fluoroprop-2-enylidene]-dimethylazanium
CID 156757937
dimethyl-[(E)-3-(methylamino)prop-2-enylidene]azanium
CID 59154262
Dimethyl-[3-(methylamino)prop-2-enylidene]azanium
CID 72542337

Frequently Asked Questions

What is the IUPAC name of [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium?
The IUPAC name of [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium (CID 134895746) is [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium.
What is the SMILES notation for [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium?
The canonical SMILES for [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium is CN/C=C(\F)C=[N+](C)C.
What is the InChIKey of [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium?
The InChIKey is YXMPSOFZEMYRGG-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H11FN2/c1-8-4-6(7)5-9(2)3/h4-5H,1-3H3/p+1.
What are the key properties of [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium?
[(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium has a molecular weight of 131.17 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-fluoro-3-(methylamino)prop-2-enylidene]-dimethylazanium is sourced from PubChem (CID 134895746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).