1-(1-fluoroethenyl)imidazole

C5H5FN2 — CID 174960352

IUPAC1-(1-fluoroethenyl)imidazole
SMILESC=C(F)n1ccnc1
InChIInChI=1S/C5H5FN2/c1-5(6)8-3-2-7-4-8/h2-4H,1H2
InChIKeyCGYBTFUQCXBITG-UHFFFAOYSA-N
MW112.11 g/mol
LogP1.28
Rot. Bonds1

About 1-(1-fluoroethenyl)imidazole

1-(1-fluoroethenyl)imidazole (PubChem CID 174960352) has the molecular formula C5H5FN2 and a molecular weight of 112.11 g/mol. Its IUPAC name is 1-(1-fluoroethenyl)imidazole.

Molecular Properties

Compound Name1-(1-fluoroethenyl)imidazole
PubChem CID174960352
Molecular FormulaC5H5FN2
Molecular Weight112.11 g/mol
Exact Mass112.04
IUPAC Name1-(1-fluoroethenyl)imidazole
SMILESC=C(F)n1ccnc1
InChIInChI=1S/C5H5FN2/c1-5(6)8-3-2-7-4-8/h2-4H,1H2
InChIKeyCGYBTFUQCXBITG-UHFFFAOYSA-N
XLogP1.28
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.11
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(Z)-2-chloro-1,2-difluoroethenyl]imidazole
CID 119084004
1-(1-ethoxyethenyl)imidazole
CID 174806747
potassium imidazole-1-carbodithioate
CID 102210808
methyl hydrogen carbonate;1-prop-1-en-2-ylimidazole
CID 174740575
2-fluoro-1-imidazol-1-yl-2-methylpropan-1-one
CID 146826103
1-(3-phenylprop-1-en-2-yl)imidazole
CID 22115010
1-imidazol-1-ylpropane-1,2-dithione
CID 87350552
buta-1,3-diene;ethane;1-imidazol-1-ylethanone
CID 143773294
1-imidazol-1-ylbut-3-en-1-one
CID 67206751
N'-[(E)-1,2-diamino-2-chloroethenyl]-2-(imidazole-1-carbonyl)prop-2-enimidamide
CID 173471345
4-(3,3-difluoro-3-sulfanylprop-1-en-2-yl)oxy-1-imidazol-1-ylbutan-1-one
CID 163596553
imidazole-1-carboximidoyl bromide
CID 89319760

Frequently Asked Questions

What is the IUPAC name of 1-(1-fluoroethenyl)imidazole?
The IUPAC name of 1-(1-fluoroethenyl)imidazole (CID 174960352) is 1-(1-fluoroethenyl)imidazole.
What is the SMILES notation for 1-(1-fluoroethenyl)imidazole?
The canonical SMILES for 1-(1-fluoroethenyl)imidazole is C=C(F)n1ccnc1.
What is the InChIKey of 1-(1-fluoroethenyl)imidazole?
The InChIKey is CGYBTFUQCXBITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FN2/c1-5(6)8-3-2-7-4-8/h2-4H,1H2.
What are the key properties of 1-(1-fluoroethenyl)imidazole?
1-(1-fluoroethenyl)imidazole has a molecular weight of 112.11 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluoroethenyl)imidazole is sourced from PubChem (CID 174960352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).