3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine

C32H20FN — CID 141380164

IUPAC3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine
SMILESFc1cncc(-c2c3ccccc3c(C3c4ccccc4-c4ccccc43)c3ccccc23)c1
InChIInChI=1S/C32H20FN/c33-21-17-20(18-34-19-21)30-26-13-5-7-15-28(26)32(29-16-8-6-14-27(29)30)31-24-11-3-1-9-22(24)23-10-2-4-12-25(23)31/h1-19,31H
InChIKeyHQUJQGAQQRWNQZ-UHFFFAOYSA-N
MW437.52 g/mol
LogP8.35
Rot. Bonds2

About 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine

3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine (PubChem CID 141380164) has the molecular formula C32H20FN and a molecular weight of 437.52 g/mol. Its IUPAC name is 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine.

Molecular Properties

Compound Name3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine
PubChem CID141380164
Molecular FormulaC32H20FN
Molecular Weight437.52 g/mol
Exact Mass437.16
IUPAC Name3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine
SMILESFc1cncc(-c2c3ccccc3c(C3c4ccccc4-c4ccccc43)c3ccccc23)c1
InChIInChI=1S/C32H20FN/c33-21-17-20(18-34-19-21)30-26-13-5-7-15-28(26)32(29-16-8-6-14-27(29)30)31-24-11-3-1-9-22(24)23-10-2-4-12-25(23)31/h1-19,31H
InChIKeyHQUJQGAQQRWNQZ-UHFFFAOYSA-N
XLogP8.35
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.52
LogP ≤ 58.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

(Isoquinolinemethylene)indane 30a
CID 6539812
3-(1,2-Dihydroacenaphthylen-3-yl)pyridine
CID 11586681
3-(Naphthalen-2-yl)pyridine
CID 11845485
4-[6-(4-Fluorophenyl)-3,4-dihydronaphthalen-1-yl]pyridine
CID 25033735
3-(3-Benzylnaphthalen-2-yl)pyridine
CID 25130517
Indeno(1,2,3-de)isoquinoline
CID 23533
5-{[(1Z)-5-fluoro-2,3-dihydro-1H-inden-1-ylidene]methyl}isoquinoline
CID 6539813
(3-Pyridylmethylene)indane 37a
CID 6539819
3-(1,2-Dihydroacenaphthylen-5-yl)pyridine
CID 23644953
4-[6-(3,4-Difluorophenyl)-3,4-dihydronaphthalen-1-yl]pyridine
CID 25033658
4-[6-(4-Fluorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine
CID 25033726
4-[6-(4-fluorophenyl)-1H-inden-3-yl]pyridine
CID 25033733

Frequently Asked Questions

What is the IUPAC name of 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine?
The IUPAC name of 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine (CID 141380164) is 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine.
What is the SMILES notation for 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine?
The canonical SMILES for 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine is Fc1cncc(-c2c3ccccc3c(C3c4ccccc4-c4ccccc43)c3ccccc23)c1.
What is the InChIKey of 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine?
The InChIKey is HQUJQGAQQRWNQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20FN/c33-21-17-20(18-34-19-21)30-26-13-5-7-15-28(26)32(29-16-8-6-14-27(29)30)31-24-11-3-1-9-22(24)23-10-2-4-12-25(23)31/h1-19,31H.
What are the key properties of 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine?
3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine has a molecular weight of 437.52 g/mol, XLogP of 8.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[10-(9H-fluoren-9-yl)anthracen-9-yl]-5-fluoropyridine is sourced from PubChem (CID 141380164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).