1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole

C12H11FN2 — CID 173228165

IUPAC1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole
SMILESC/C=C(\F)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C12H11FN2/c1-2-12(13)10-3-5-11(6-4-10)15-8-7-14-9-15/h2-9H,1H3/b12-2-
InChIKeyPDTBEFCUQWUYSY-OIXVIMQBSA-N
MW202.23 g/mol
LogP3.20
Rot. Bonds2

About 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole

1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole (PubChem CID 173228165) has the molecular formula C12H11FN2 and a molecular weight of 202.23 g/mol. Its IUPAC name is 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole.

Molecular Properties

Compound Name1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole
PubChem CID173228165
Molecular FormulaC12H11FN2
Molecular Weight202.23 g/mol
Exact Mass202.09
IUPAC Name1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole
SMILESC/C=C(\F)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C12H11FN2/c1-2-12(13)10-3-5-11(6-4-10)15-8-7-14-9-15/h2-9H,1H3/b12-2-
InChIKeyPDTBEFCUQWUYSY-OIXVIMQBSA-N
XLogP3.20
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.23
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-imidazol-1-ylphenyl)ethanimine
CID 167508669
(E)-1-(4-fluorophenyl)-4-(4-imidazol-1-ylphenyl)but-2-ene-1,4-dione
CID 125485189
1-(4-fluorophenyl)imidazole;hydrobromide
CID 175571353
N'-hydroxy-4-imidazol-1-ylbenzenecarboximidamide
CID 43188203
2-[(Z)-1-(4-imidazol-1-ylphenyl)ethylideneamino]guanidine
CID 6061975
2-(4-imidazol-1-ylphenyl)prop-2-enoic acid
CID 69134424
(4-imidazol-1-ylphenyl)arsane
CID 173134933
(4-imidazol-1-ylphenyl)methyl-methylazanium
CID 7157370
N-(4-imidazol-1-ylphenyl)acetamide
CID 16761727
sodium 1,1,1-trifluoro-4-(4-imidazol-1-ylphenyl)-4-oxobut-2-en-2-olate
CID 53396078
1-[4-[3,5-bis(4-imidazol-1-ylphenyl)phenyl]phenyl]imidazole
CID 102142171
1-[4-[1,2,2-tris(4-imidazol-1-ylphenyl)ethyl]phenyl]imidazole
CID 162718283

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole?
The IUPAC name of 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole (CID 173228165) is 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole.
What is the SMILES notation for 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole?
The canonical SMILES for 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole is C/C=C(\F)c1ccc(-n2ccnc2)cc1.
What is the InChIKey of 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole?
The InChIKey is PDTBEFCUQWUYSY-OIXVIMQBSA-N. The full InChI is InChI=1S/C12H11FN2/c1-2-12(13)10-3-5-11(6-4-10)15-8-7-14-9-15/h2-9H,1H3/b12-2-.
What are the key properties of 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole?
1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole has a molecular weight of 202.23 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]imidazole is sourced from PubChem (CID 173228165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).