4-(4-fluoranthen-2-ylphenyl)pyridine

C27H17N — CID 130295099

IUPAC4-(4-fluoranthen-2-ylphenyl)pyridine
SMILESc1ccc2c(c1)-c1cccc3cc(-c4ccc(-c5ccncc5)cc4)cc-2c13
InChIInChI=1S/C27H17N/c1-2-6-24-23(5-1)25-7-3-4-21-16-22(17-26(24)27(21)25)19-10-8-18(9-11-19)20-12-14-28-15-13-20/h1-17H
InChIKeyWCEHPWSANJXMNQ-UHFFFAOYSA-N
MW355.44 g/mol
LogP7.22
Rot. Bonds2

About 4-(4-fluoranthen-2-ylphenyl)pyridine

4-(4-fluoranthen-2-ylphenyl)pyridine (PubChem CID 130295099) has the molecular formula C27H17N and a molecular weight of 355.44 g/mol. Its IUPAC name is 4-(4-fluoranthen-2-ylphenyl)pyridine.

Molecular Properties

Compound Name4-(4-fluoranthen-2-ylphenyl)pyridine
PubChem CID130295099
Molecular FormulaC27H17N
Molecular Weight355.44 g/mol
Exact Mass355.14
IUPAC Name4-(4-fluoranthen-2-ylphenyl)pyridine
SMILESc1ccc2c(c1)-c1cccc3cc(-c4ccc(-c5ccncc5)cc4)cc-2c13
InChIInChI=1S/C27H17N/c1-2-6-24-23(5-1)25-7-3-4-21-16-22(17-26(24)27(21)25)19-10-8-18(9-11-19)20-12-14-28-15-13-20/h1-17H
InChIKeyWCEHPWSANJXMNQ-UHFFFAOYSA-N
XLogP7.22
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.44
LogP ≤ 57.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoranthen-2-ylphenyl)pyridine?
The IUPAC name of 4-(4-fluoranthen-2-ylphenyl)pyridine (CID 130295099) is 4-(4-fluoranthen-2-ylphenyl)pyridine.
What is the SMILES notation for 4-(4-fluoranthen-2-ylphenyl)pyridine?
The canonical SMILES for 4-(4-fluoranthen-2-ylphenyl)pyridine is c1ccc2c(c1)-c1cccc3cc(-c4ccc(-c5ccncc5)cc4)cc-2c13.
What is the InChIKey of 4-(4-fluoranthen-2-ylphenyl)pyridine?
The InChIKey is WCEHPWSANJXMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17N/c1-2-6-24-23(5-1)25-7-3-4-21-16-22(17-26(24)27(21)25)19-10-8-18(9-11-19)20-12-14-28-15-13-20/h1-17H.
What are the key properties of 4-(4-fluoranthen-2-ylphenyl)pyridine?
4-(4-fluoranthen-2-ylphenyl)pyridine has a molecular weight of 355.44 g/mol, XLogP of 7.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoranthen-2-ylphenyl)pyridine is sourced from PubChem (CID 130295099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).