6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine

C30H18N2O — CID 176818950

IUPAC6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine
SMILESc1ccc2c(c1)nc(-c1ccc(-c3ccc4oc5ccccc5c4c3)cn1)c1ccccc12
InChIInChI=1S/C30H18N2O/c1-2-10-24-21(7-1)22-8-3-5-11-26(22)32-30(24)27-15-13-20(18-31-27)19-14-16-29-25(17-19)23-9-4-6-12-28(23)33-29/h1-18H
InChIKeyFEVHFVLQXOYGMF-UHFFFAOYSA-N
MW422.49 g/mol
LogP8.02
Rot. Bonds2

About 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine

6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine (PubChem CID 176818950) has the molecular formula C30H18N2O and a molecular weight of 422.49 g/mol. Its IUPAC name is 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine.

Molecular Properties

Compound Name6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine
PubChem CID176818950
Molecular FormulaC30H18N2O
Molecular Weight422.49 g/mol
Exact Mass422.14
IUPAC Name6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine
SMILESc1ccc2c(c1)nc(-c1ccc(-c3ccc4oc5ccccc5c4c3)cn1)c1ccccc12
InChIInChI=1S/C30H18N2O/c1-2-10-24-21(7-1)22-8-3-5-11-26(22)32-30(24)27-15-13-20(18-31-27)19-14-16-29-25(17-19)23-9-4-6-12-28(23)33-29/h1-18H
InChIKeyFEVHFVLQXOYGMF-UHFFFAOYSA-N
XLogP8.02
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.49
LogP ≤ 58.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

6-(5-triphenylen-2-yl-2-pyridinyl)phenanthridine
CID 176818864
6-(5-naphtho[2,1-b][1]benzofuran-9-yl-2-pyridinyl)phenanthridine
CID 176818947
6-(5-dibenzofuran-1-yl-2-pyridinyl)phenanthridine
CID 176819030
6-[5-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-pyridinyl]phenanthridine
CID 176819218
6-[5-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-2-pyridinyl]phenanthridine
CID 176819149
6-[5-[3-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-2-pyridinyl]phenanthridine
CID 176819205
3-(6-dibenzofuran-2-yl-3-pyridinyl)-7-(4-fluorophenyl)quinoline
CID 169293939
2-(4-dibenzofuran-2-ylphenyl)-5-[10-(4-phenylphenyl)anthracen-9-yl]pyridine
CID 147052468
2-dibenzofuran-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine
CID 169293876
[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane
CID 169293694
6-[5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]phenanthridine
CID 176818956
6-[5-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-2-pyridinyl]phenanthridine
CID 176819007

Frequently Asked Questions

What is the IUPAC name of 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine?
The IUPAC name of 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine (CID 176818950) is 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine.
What is the SMILES notation for 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine?
The canonical SMILES for 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine is c1ccc2c(c1)nc(-c1ccc(-c3ccc4oc5ccccc5c4c3)cn1)c1ccccc12.
What is the InChIKey of 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine?
The InChIKey is FEVHFVLQXOYGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H18N2O/c1-2-10-24-21(7-1)22-8-3-5-11-26(22)32-30(24)27-15-13-20(18-31-27)19-14-16-29-25(17-19)23-9-4-6-12-28(23)33-29/h1-18H.
What are the key properties of 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine?
6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine has a molecular weight of 422.49 g/mol, XLogP of 8.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine is sourced from PubChem (CID 176818950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).