2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine

C35H22FNO — CID 165385994

IUPAC2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine
SMILESFc1ccc2c(oc3c(-c4ccccn4)cccc32)c1-c1ccc(-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C35H22FNO/c36-31-21-20-29-28-9-6-10-30(32-11-4-5-22-37-32)34(28)38-35(29)33(31)27-18-16-26(17-19-27)25-14-12-24(13-15-25)23-7-2-1-3-8-23/h1-22H
InChIKeyXKZWGWMYDCCZIC-UHFFFAOYSA-N
MW491.57 g/mol
LogP9.79
Rot. Bonds4

About 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine

2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine (PubChem CID 165385994) has the molecular formula C35H22FNO and a molecular weight of 491.57 g/mol. Its IUPAC name is 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine.

Molecular Properties

Compound Name2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine
PubChem CID165385994
Molecular FormulaC35H22FNO
Molecular Weight491.57 g/mol
Exact Mass491.17
IUPAC Name2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine
SMILESFc1ccc2c(oc3c(-c4ccccn4)cccc32)c1-c1ccc(-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C35H22FNO/c36-31-21-20-29-28-9-6-10-30(32-11-4-5-22-37-32)34(28)38-35(29)33(31)27-18-16-26(17-19-27)25-14-12-24(13-15-25)23-7-2-1-3-8-23/h1-22H
InChIKeyXKZWGWMYDCCZIC-UHFFFAOYSA-N
XLogP9.79
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.57
LogP ≤ 59.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-4-fluoro-2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine
CID 170152904
2-[7-fluoro-6-(1,1,3,3-tetradeuterio-2,2-dimethylcyclopenta[b]naphthalen-6-yl)dibenzofuran-4-yl]pyridine
CID 166051431
2-(6-fluoro-7-isocyanodibenzofuran-4-yl)pyridine
CID 154616033
2-dibenzofuran-4-ylpyridine
CID 59500175
4-(3-cyanophenyl)-6-pyridin-2-yldibenzofuran-3-carbonitrile
CID 166043478
2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine
CID 171761185
2-[6-(2-phenylpropan-2-yl)dibenzofuran-4-yl]pyridine
CID 162707082
2-(6-methyldibenzofuran-4-yl)-4-phenylpyridine
CID 140775821
4-phenanthren-2-yl-6-pyridin-2-yldibenzofuran-3-carbonitrile
CID 169077042
2-[4-[3-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]dibenzofuran-4-yl]phenyl]-4-(4-phenylphenyl)pyridine
CID 153458075
4-[4-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
CID 171761226
3-methyl-10-pyridin-2-yl-[1]benzofuro[3,2-h]isoquinoline
CID 172522612

Frequently Asked Questions

What is the IUPAC name of 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine?
The IUPAC name of 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine (CID 165385994) is 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine.
What is the SMILES notation for 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine?
The canonical SMILES for 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine is Fc1ccc2c(oc3c(-c4ccccn4)cccc32)c1-c1ccc(-c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine?
The InChIKey is XKZWGWMYDCCZIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H22FNO/c36-31-21-20-29-28-9-6-10-30(32-11-4-5-22-37-32)34(28)38-35(29)33(31)27-18-16-26(17-19-27)25-14-12-24(13-15-25)23-7-2-1-3-8-23/h1-22H.
What are the key properties of 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine?
2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine has a molecular weight of 491.57 g/mol, XLogP of 9.79, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine is sourced from PubChem (CID 165385994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).