5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol

C5H5FN2O — CID 123703941

IUPAC5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol
SMILESOc1nc[nH]c1/C=C/F
InChIInChI=1S/C5H5FN2O/c6-2-1-4-5(9)8-3-7-4/h1-3,9H,(H,7,8)/b2-1+
InChIKeyUGNKHOSCDJZOIL-OWOJBTEDSA-N
MW128.11 g/mol
LogP1.06
Rot. Bonds1

About 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol

5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol (PubChem CID 123703941) has the molecular formula C5H5FN2O and a molecular weight of 128.11 g/mol. Its IUPAC name is 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol.

Molecular Properties

Compound Name5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol
PubChem CID123703941
Molecular FormulaC5H5FN2O
Molecular Weight128.11 g/mol
Exact Mass128.04
IUPAC Name5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol
SMILESOc1nc[nH]c1/C=C/F
InChIInChI=1S/C5H5FN2O/c6-2-1-4-5(9)8-3-7-4/h1-3,9H,(H,7,8)/b2-1+
InChIKeyUGNKHOSCDJZOIL-OWOJBTEDSA-N
XLogP1.06
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.11
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol?
The IUPAC name of 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol (CID 123703941) is 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol.
What is the SMILES notation for 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol?
The canonical SMILES for 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol is Oc1nc[nH]c1/C=C/F.
What is the InChIKey of 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol?
The InChIKey is UGNKHOSCDJZOIL-OWOJBTEDSA-N. The full InChI is InChI=1S/C5H5FN2O/c6-2-1-4-5(9)8-3-7-4/h1-3,9H,(H,7,8)/b2-1+.
What are the key properties of 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol?
5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol has a molecular weight of 128.11 g/mol, XLogP of 1.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(E)-2-fluoroethenyl]-1H-imidazol-4-ol is sourced from PubChem (CID 123703941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).