4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol

C19H14FNO — CID 171060820

IUPAC4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol
SMILESOc1ccc(F)cc1/C(=C/c1ccccn1)c1ccccc1
InChIInChI=1S/C19H14FNO/c20-15-9-10-19(22)18(12-15)17(14-6-2-1-3-7-14)13-16-8-4-5-11-21-16/h1-13,22H/b17-13+
InChIKeyWVZKYDGVQSJEMM-GHRIWEEISA-N
MW291.32 g/mol
LogP4.52
Rot. Bonds3

About 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol

4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol (PubChem CID 171060820) has the molecular formula C19H14FNO and a molecular weight of 291.32 g/mol. Its IUPAC name is 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol.

Molecular Properties

Compound Name4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol
PubChem CID171060820
Molecular FormulaC19H14FNO
Molecular Weight291.32 g/mol
Exact Mass291.11
IUPAC Name4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol
SMILESOc1ccc(F)cc1/C(=C/c1ccccn1)c1ccccc1
InChIInChI=1S/C19H14FNO/c20-15-9-10-19(22)18(12-15)17(14-6-2-1-3-7-14)13-16-8-4-5-11-21-16/h1-13,22H/b17-13+
InChIKeyWVZKYDGVQSJEMM-GHRIWEEISA-N
XLogP4.52
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.32
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol?
The IUPAC name of 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol (CID 171060820) is 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol.
What is the SMILES notation for 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol?
The canonical SMILES for 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol is Oc1ccc(F)cc1/C(=C/c1ccccn1)c1ccccc1.
What is the InChIKey of 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol?
The InChIKey is WVZKYDGVQSJEMM-GHRIWEEISA-N. The full InChI is InChI=1S/C19H14FNO/c20-15-9-10-19(22)18(12-15)17(14-6-2-1-3-7-14)13-16-8-4-5-11-21-16/h1-13,22H/b17-13+.
What are the key properties of 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol?
4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol has a molecular weight of 291.32 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[(E)-1-phenyl-2-pyridin-2-ylethenyl]phenol is sourced from PubChem (CID 171060820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).