2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine

C26H20FNO — CID 166573402

IUPAC2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine
SMILESCC(C)c1ccnc(-c2ccc(F)c3c2oc2cc(-c4ccccc4)ccc23)c1
InChIInChI=1S/C26H20FNO/c1-16(2)18-12-13-28-23(14-18)20-10-11-22(27)25-21-9-8-19(15-24(21)29-26(20)25)17-6-4-3-5-7-17/h3-16H,1-2H3
InChIKeyWARJQGCQEVESEJ-UHFFFAOYSA-N
MW381.45 g/mol
LogP7.58
Rot. Bonds3

About 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine

2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine (PubChem CID 166573402) has the molecular formula C26H20FNO and a molecular weight of 381.45 g/mol. Its IUPAC name is 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine.

Molecular Properties

Compound Name2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine
PubChem CID166573402
Molecular FormulaC26H20FNO
Molecular Weight381.45 g/mol
Exact Mass381.15
IUPAC Name2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine
SMILESCC(C)c1ccnc(-c2ccc(F)c3c2oc2cc(-c4ccccc4)ccc23)c1
InChIInChI=1S/C26H20FNO/c1-16(2)18-12-13-28-23(14-18)20-10-11-22(27)25-21-9-8-19(15-24(21)29-26(20)25)17-6-4-3-5-7-17/h3-16H,1-2H3
InChIKeyWARJQGCQEVESEJ-UHFFFAOYSA-N
XLogP7.58
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.45
LogP ≤ 57.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-deuteriopropan-2-yl)-2-(1-phenyldibenzofuran-4-yl)pyridine
CID 166575304
2-(7-benzyl-1-methyldibenzofuran-4-yl)-4-propan-2-ylpyridine
CID 162708417
4-(2-deuteriopropan-2-yl)-2-(7-phenyldibenzofuran-2-yl)pyridine
CID 155611009
4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine
CID 140607533
5-methyl-2-phenyl-8-(4-propan-2-yl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine
CID 155610853
4-(2-deuteriopropan-2-yl)-2-[7-[4-(trideuteriomethyl)phenyl]dibenzofuran-4-yl]pyridine
CID 166573548
2-dibenzofuran-4-yl-4-propan-2-ylpyridine
CID 71236331
3-phenyl-8-(4-propan-2-yl-2-pyridinyl)-[1]benzofuro[2,3-c]pyridine
CID 155610525
4-(1-phenylethyl)-2-[8-(4-phenylphenyl)dibenzofuran-4-yl]pyridine
CID 166575689
2-(1-fluoro-7-phenyldibenzofuran-4-yl)-1-[4-(4-phenylphenyl)-2,6-di(propan-2-yl)phenyl]benzimidazole
CID 169299441
2-[7-(4-fluorophenyl)-6-(trideuteriomethyl)dibenzofuran-4-yl]-4-propan-2-ylpyridine
CID 166576213
trimethyl-[4-phenyl-6-(4-propan-2-yl-2-pyridinyl)dibenzofuran-3-yl]germane
CID 164832486

Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine?
The IUPAC name of 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine (CID 166573402) is 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine.
What is the SMILES notation for 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine?
The canonical SMILES for 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine is CC(C)c1ccnc(-c2ccc(F)c3c2oc2cc(-c4ccccc4)ccc23)c1.
What is the InChIKey of 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine?
The InChIKey is WARJQGCQEVESEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20FNO/c1-16(2)18-12-13-28-23(14-18)20-10-11-22(27)25-21-9-8-19(15-24(21)29-26(20)25)17-6-4-3-5-7-17/h3-16H,1-2H3.
What are the key properties of 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine?
2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine has a molecular weight of 381.45 g/mol, XLogP of 7.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoro-7-phenyldibenzofuran-4-yl)-4-propan-2-ylpyridine is sourced from PubChem (CID 166573402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).