2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol

C18H13FN2O — CID 142259502

IUPAC2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol
SMILESOc1ccc(/C=C/c2ccc(-c3ccccn3)nc2)cc1F
InChIInChI=1S/C18H13FN2O/c19-15-11-13(7-9-18(15)22)4-5-14-6-8-17(21-12-14)16-3-1-2-10-20-16/h1-12,22H/b5-4+
InChIKeyVTKXNQHCWRPDRE-SNAWJCMRSA-N
MW292.31 g/mol
LogP4.16
Rot. Bonds3

About 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol

2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol (PubChem CID 142259502) has the molecular formula C18H13FN2O and a molecular weight of 292.31 g/mol. Its IUPAC name is 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol.

Molecular Properties

Compound Name2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol
PubChem CID142259502
Molecular FormulaC18H13FN2O
Molecular Weight292.31 g/mol
Exact Mass292.10
IUPAC Name2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol
SMILESOc1ccc(/C=C/c2ccc(-c3ccccn3)nc2)cc1F
InChIInChI=1S/C18H13FN2O/c19-15-11-13(7-9-18(15)22)4-5-14-6-8-17(21-12-14)16-3-1-2-10-20-16/h1-12,22H/b5-4+
InChIKeyVTKXNQHCWRPDRE-SNAWJCMRSA-N
XLogP4.16
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.31
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
NoName_714
CID 135489221
3-[5-(3-Hydroxyphenyl)pyridin-2-yl]phenol
CID 25093398
3-[5-(3-Hydroxyphenyl)pyrazin-2-yl]phenol
CID 25093399
3-Fluoro-4''-(1-(pyridin-4-yl)propyl)biphenyl-4-ol
CID 46854606
4''-(Pyridin-4-ylmethyl)biphenyl-3-ol
CID 46901446
3-Fluoro-4''-(pyridin-4-ylmethyl)biphenyl-4-ol
CID 46901611
2,6-Difluoro-4-[4-[4-(4-methylpiperazin-1-yl)phenyl]pyridin-3-yl]phenol
CID 73010393
3-(2,4-Dihydroxybenzylidene)anabaseine
CID 135461178
Phenol, p-[2-(4-quinolyl)vinyl]-
CID 741423
4-[2-(2-Pyridinyl)ethyl]phenol
CID 279650
4-Quinoxalin-2-ylphenol
CID 787366

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol?
The IUPAC name of 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol (CID 142259502) is 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol.
What is the SMILES notation for 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol?
The canonical SMILES for 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol is Oc1ccc(/C=C/c2ccc(-c3ccccn3)nc2)cc1F.
What is the InChIKey of 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol?
The InChIKey is VTKXNQHCWRPDRE-SNAWJCMRSA-N. The full InChI is InChI=1S/C18H13FN2O/c19-15-11-13(7-9-18(15)22)4-5-14-6-8-17(21-12-14)16-3-1-2-10-20-16/h1-12,22H/b5-4+.
What are the key properties of 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol?
2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol has a molecular weight of 292.31 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[(E)-2-(6-pyridin-2-yl-3-pyridinyl)ethenyl]phenol is sourced from PubChem (CID 142259502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).