4-fluoro-2-(1-imidazol-1-ylethenyl)phenol

C11H9FN2O — CID 14349376

IUPAC4-fluoro-2-(1-imidazol-1-ylethenyl)phenol
SMILESC=C(c1cc(F)ccc1O)n1ccnc1
InChIInChI=1S/C11H9FN2O/c1-8(14-5-4-13-7-14)10-6-9(12)2-3-11(10)15/h2-7,15H,1H2
InChIKeyCUUAHYQCDISBMB-UHFFFAOYSA-N
MW204.20 g/mol
LogP2.25
Rot. Bonds2

About 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol

4-fluoro-2-(1-imidazol-1-ylethenyl)phenol (PubChem CID 14349376) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol.

Molecular Properties

Compound Name4-fluoro-2-(1-imidazol-1-ylethenyl)phenol
PubChem CID14349376
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name4-fluoro-2-(1-imidazol-1-ylethenyl)phenol
SMILESC=C(c1cc(F)ccc1O)n1ccnc1
InChIInChI=1S/C11H9FN2O/c1-8(14-5-4-13-7-14)10-6-9(12)2-3-11(10)15/h2-7,15H,1H2
InChIKeyCUUAHYQCDISBMB-UHFFFAOYSA-N
XLogP2.25
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol?
The IUPAC name of 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol (CID 14349376) is 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol.
What is the SMILES notation for 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol?
The canonical SMILES for 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol is C=C(c1cc(F)ccc1O)n1ccnc1.
What is the InChIKey of 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol?
The InChIKey is CUUAHYQCDISBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c1-8(14-5-4-13-7-14)10-6-9(12)2-3-11(10)15/h2-7,15H,1H2.
What are the key properties of 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol?
4-fluoro-2-(1-imidazol-1-ylethenyl)phenol has a molecular weight of 204.20 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(1-imidazol-1-ylethenyl)phenol is sourced from PubChem (CID 14349376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).