N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine

C60H38N2O — CID 153314874

IUPACN-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
SMILESc1cc(N(c2ccc(-c3ccccc3-c3ccc4c(c3)oc3ccccc34)cc2)c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C60H38N2O/c1-2-17-46(40-30-34-55-54-24-9-12-27-59(54)63-60(55)36-40)45(16-1)39-28-31-41(32-29-39)61(44-33-35-51-49-20-4-3-18-47(49)48-19-5-6-21-50(48)56(51)38-44)42-14-13-15-43(37-42)62-57-25-10-7-22-52(57)53-23-8-11-26-58(53)62/h1-38H
InChIKeyNHVCZTKARYSOOH-UHFFFAOYSA-N
MW802.98 g/mol
LogP16.95
Rot. Bonds6

About N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine

N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine (PubChem CID 153314874) has the molecular formula C60H38N2O and a molecular weight of 802.98 g/mol. Its IUPAC name is N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine.

Molecular Properties

Compound NameN-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
PubChem CID153314874
Molecular FormulaC60H38N2O
Molecular Weight802.98 g/mol
Exact Mass802.30
IUPAC NameN-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
SMILESc1cc(N(c2ccc(-c3ccccc3-c3ccc4c(c3)oc3ccccc34)cc2)c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C60H38N2O/c1-2-17-46(40-30-34-55-54-24-9-12-27-59(54)63-60(55)36-40)45(16-1)39-28-31-41(32-29-39)61(44-33-35-51-49-20-4-3-18-47(49)48-19-5-6-21-50(48)56(51)38-44)42-14-13-15-43(37-42)62-57-25-10-7-22-52(57)53-23-8-11-26-58(53)62/h1-38H
InChIKeyNHVCZTKARYSOOH-UHFFFAOYSA-N
XLogP16.95
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500802.98
LogP ≤ 516.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline
CID 153314748
4-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]-N-phenylaniline
CID 153314587
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
CID 153314743
N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]-2-(4-phenylphenyl)aniline
CID 153315196
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(3-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
CID 153315214
N-(3-carbazol-9-ylphenyl)-N-[4-(4-dibenzofuran-3-ylphenyl)phenyl]-3-phenylaniline
CID 153314771
3-carbazol-9-yl-N-(4-dibenzofuran-1-ylphenyl)-N-phenylaniline
CID 155397910
N-(3-carbazol-9-ylphenyl)-N-(4-dibenzofuran-3-ylphenyl)-3-(3-phenylphenyl)aniline
CID 153315131
N-(3-carbazol-9-ylphenyl)-3-[4-[9-[3-(4-dibenzofuran-3-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]carbazol-3-yl]naphthalen-1-yl]-N-(4-dibenzofuran-3-ylphenyl)aniline
CID 167179628
N-[4-(3-carbazol-9-ylphenyl)phenyl]-3-(4-dibenzofuran-3-ylphenyl)-N-(4-phenylphenyl)aniline
CID 147399536
3-carbazol-9-yl-N-(4-dibenzofuran-3-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 146578380
8-N,22-N-bis(3-carbazol-9-ylphenyl)-8-N,22-N-di(dibenzofuran-3-yl)-5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaene-8,22-diamine
CID 164999307

Frequently Asked Questions

What is the IUPAC name of N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine?
The IUPAC name of N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine (CID 153314874) is N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine.
What is the SMILES notation for N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine?
The canonical SMILES for N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine is c1cc(N(c2ccc(-c3ccccc3-c3ccc4c(c3)oc3ccccc34)cc2)c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine?
The InChIKey is NHVCZTKARYSOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H38N2O/c1-2-17-46(40-30-34-55-54-24-9-12-27-59(54)63-60(55)36-40)45(16-1)39-28-31-41(32-29-39)61(44-33-35-51-49-20-4-3-18-47(49)48-19-5-6-21-50(48)56(51)38-44)42-14-13-15-43(37-42)62-57-25-10-7-22-52(57)53-23-8-11-26-58(53)62/h1-38H.
What are the key properties of N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine?
N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine has a molecular weight of 802.98 g/mol, XLogP of 16.95, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine is sourced from PubChem (CID 153314874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).