2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine

C19H11FN2 — CID 157059916

IUPAC2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine
SMILES[C-]#[N+]c1c(F)ccc2c1Cc1c(-c3ccccn3)cccc1-2
InChIInChI=1S/C19H11FN2/c1-21-19-16-11-15-12(13(16)8-9-17(19)20)5-4-6-14(15)18-7-2-3-10-22-18/h2-10H,11H2
InChIKeyULLGCRNXEYYTGE-UHFFFAOYSA-N
MW286.31 g/mol
LogP5.01
Rot. Bonds1

About 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine

2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine (PubChem CID 157059916) has the molecular formula C19H11FN2 and a molecular weight of 286.31 g/mol. Its IUPAC name is 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine.

Molecular Properties

Compound Name2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine
PubChem CID157059916
Molecular FormulaC19H11FN2
Molecular Weight286.31 g/mol
Exact Mass286.09
IUPAC Name2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine
SMILES[C-]#[N+]c1c(F)ccc2c1Cc1c(-c3ccccn3)cccc1-2
InChIInChI=1S/C19H11FN2/c1-21-19-16-11-15-12(13(16)8-9-17(19)20)5-4-6-14(15)18-7-2-3-10-22-18/h2-10H,11H2
InChIKeyULLGCRNXEYYTGE-UHFFFAOYSA-N
XLogP5.01
TPSA17.25 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.31
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

2-(6-isocyano-9H-fluoren-1-yl)pyridine
CID 162258416
2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;iridium
CID 58880833
2-(4-chloro-2-fluorophenyl)pyridine
CID 57200729
1,1,4,4-tetramethyl-10-pyridin-2-yl-3,11-dihydro-2H-indeno[1,2-c]quinoline
CID 157110490
2-(5-fluoro-4-isocyano-2-methylphenyl)pyridine
CID 153319439
cesium 2,6-dipyridin-2-ylphenolate
CID 59522981
2-(2-fluoro-3-methylphenyl)pyridine
CID 175536337
2-pyridin-2-yl-9H-fluoren-1-ol
CID 151501433
2-(7-isocyano-8-methyl-6-propan-2-yldibenzofuran-4-yl)pyridine
CID 154615180
2-(6-fluoro-7-isocyanodibenzofuran-4-yl)pyridine
CID 154616033
2-fluoro-3-pyridin-2-ylaniline
CID 176913716
methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine
CID 158375243

Frequently Asked Questions

What is the IUPAC name of 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine?
The IUPAC name of 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine (CID 157059916) is 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine.
What is the SMILES notation for 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine?
The canonical SMILES for 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine is [C-]#[N+]c1c(F)ccc2c1Cc1c(-c3ccccn3)cccc1-2.
What is the InChIKey of 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine?
The InChIKey is ULLGCRNXEYYTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11FN2/c1-21-19-16-11-15-12(13(16)8-9-17(19)20)5-4-6-14(15)18-7-2-3-10-22-18/h2-10H,11H2.
What are the key properties of 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine?
2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine has a molecular weight of 286.31 g/mol, XLogP of 5.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluoro-8-isocyano-9H-fluoren-1-yl)pyridine is sourced from PubChem (CID 157059916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).