N-triphenylen-2-yldibenzofuran-1-amine

C30H19NO — CID 162427617

IUPACN-triphenylen-2-yldibenzofuran-1-amine
SMILESc1ccc2c(c1)oc1cccc(Nc3ccc4c5ccccc5c5ccccc5c4c3)c12
InChIInChI=1S/C30H19NO/c1-2-10-22-20(8-1)21-9-3-4-11-23(21)26-18-19(16-17-24(22)26)31-27-13-7-15-29-30(27)25-12-5-6-14-28(25)32-29/h1-18,31H
InChIKeyZGZDUEWLVATELE-UHFFFAOYSA-N
MW409.49 g/mol
LogP8.79
Rot. Bonds2

About N-triphenylen-2-yldibenzofuran-1-amine

N-triphenylen-2-yldibenzofuran-1-amine (PubChem CID 162427617) has the molecular formula C30H19NO and a molecular weight of 409.49 g/mol. Its IUPAC name is N-triphenylen-2-yldibenzofuran-1-amine.

Molecular Properties

Compound NameN-triphenylen-2-yldibenzofuran-1-amine
PubChem CID162427617
Molecular FormulaC30H19NO
Molecular Weight409.49 g/mol
Exact Mass409.15
IUPAC NameN-triphenylen-2-yldibenzofuran-1-amine
SMILESc1ccc2c(c1)oc1cccc(Nc3ccc4c5ccccc5c5ccccc5c4c3)c12
InChIInChI=1S/C30H19NO/c1-2-10-22-20(8-1)21-9-3-4-11-23(21)26-18-19(16-17-24(22)26)31-27-13-7-15-29-30(27)25-12-5-6-14-28(25)32-29/h1-18,31H
InChIKeyZGZDUEWLVATELE-UHFFFAOYSA-N
XLogP8.79
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.49
LogP ≤ 58.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-dibenzofuran-1-yldibenzofuran-2-amine
CID 164743454
N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 163590855
N-(4-naphthalen-2-ylphenyl)dibenzofuran-1-amine
CID 159380478
N-[3-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-1-amine
CID 170108986
N-triphenylen-2-yl-1-benzofuran-3-amine
CID 171751242
N-dibenzofuran-1-yldibenzofuran-4-amine
CID 138484831
8-phenyl-N-(3-phenylphenyl)dibenzofuran-1-amine
CID 176759717
N-(4-phenanthren-2-ylphenyl)-7-phenyldibenzofuran-1-amine
CID 167397588
N-methyldibenzofuran-1-amine
CID 135277683
N-dibenzofuran-2-yldibenzofuran-3-amine;ethane
CID 145077285
6-phenyl-N-(9-phenyldibenzofuran-2-yl)dibenzofuran-4-amine
CID 170320152
N-naphtho[2,3-b][1]benzofuran-1-yl-9-phenylcarbazol-2-amine
CID 167031851

Frequently Asked Questions

What is the IUPAC name of N-triphenylen-2-yldibenzofuran-1-amine?
The IUPAC name of N-triphenylen-2-yldibenzofuran-1-amine (CID 162427617) is N-triphenylen-2-yldibenzofuran-1-amine.
What is the SMILES notation for N-triphenylen-2-yldibenzofuran-1-amine?
The canonical SMILES for N-triphenylen-2-yldibenzofuran-1-amine is c1ccc2c(c1)oc1cccc(Nc3ccc4c5ccccc5c5ccccc5c4c3)c12.
What is the InChIKey of N-triphenylen-2-yldibenzofuran-1-amine?
The InChIKey is ZGZDUEWLVATELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19NO/c1-2-10-22-20(8-1)21-9-3-4-11-23(21)26-18-19(16-17-24(22)26)31-27-13-7-15-29-30(27)25-12-5-6-14-28(25)32-29/h1-18,31H.
What are the key properties of N-triphenylen-2-yldibenzofuran-1-amine?
N-triphenylen-2-yldibenzofuran-1-amine has a molecular weight of 409.49 g/mol, XLogP of 8.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-triphenylen-2-yldibenzofuran-1-amine is sourced from PubChem (CID 162427617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).