(9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine

C55H36N2O — CID 145167549

IUPAC(9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine
SMILESNc1cccc2c1/C(=C\Cc1ccc3cc(-c4ccc5c(c4)c4cc(-c6ccc7oc8ccccc8c7c6)ccc4n5-c4ccccc4)ccc3c1)c1ccccc1-2
InChIInChI=1S/C55H36N2O/c56-50-15-8-14-45-42-11-4-5-12-43(42)46(55(45)50)25-18-34-17-19-36-30-37(21-20-35(36)29-34)38-22-26-51-47(31-38)48-32-39(23-27-52(48)57(51)41-9-2-1-3-10-41)40-24-28-54-49(33-40)44-13-6-7-16-53(44)58-54/h1-17,19-33H,18,56H2/b46-25-
InChIKeyVIZNEBJATGNHOY-HSRNTDFQSA-N
MW740.91 g/mol
LogP14.41
Rot. Bonds5

About (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine

(9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine (PubChem CID 145167549) has the molecular formula C55H36N2O and a molecular weight of 740.91 g/mol. Its IUPAC name is (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine.

Molecular Properties

Compound Name(9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine
PubChem CID145167549
Molecular FormulaC55H36N2O
Molecular Weight740.91 g/mol
Exact Mass740.28
IUPAC Name(9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine
SMILESNc1cccc2c1/C(=C\Cc1ccc3cc(-c4ccc5c(c4)c4cc(-c6ccc7oc8ccccc8c7c6)ccc4n5-c4ccccc4)ccc3c1)c1ccccc1-2
InChIInChI=1S/C55H36N2O/c56-50-15-8-14-45-42-11-4-5-12-43(42)46(55(45)50)25-18-34-17-19-36-30-37(21-20-35(36)29-34)38-22-26-51-47(31-38)48-32-39(23-27-52(48)57(51)41-9-2-1-3-10-41)40-24-28-54-49(33-40)44-13-6-7-16-53(44)58-54/h1-17,19-33H,18,56H2/b46-25-
InChIKeyVIZNEBJATGNHOY-HSRNTDFQSA-N
XLogP14.41
TPSA44.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.91
LogP ≤ 514.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(9Z)-9-[2-[6-[3-(11-phenylbenzo[a]carbazol-8-yl)carbazol-9-yl]naphthalen-2-yl]ethylidene]fluoren-1-amine
CID 145167562
3-dibenzofuran-2-yl-6-fluoranthen-3-yl-9-phenylcarbazole
CID 122434706
3-(8-dibenzofuran-2-yldibenzofuran-2-yl)-6,9-diphenylcarbazole
CID 71278016
3-(2-dibenzofuran-2-ylphenyl)-9-phenylcarbazole
CID 139423478
3-(8,15-dioxatetracyclo[14.4.0.02,7.09,14]icosa-1(20),2(7),3,5,9,11,13,16,18-nonaen-4-yl)-9-phenylcarbazole
CID 145223329
3-[9-[4-naphthalen-2-yl-6-[8-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 167377389
3-dibenzofuran-1-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-2-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-3-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 163841517
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 158532240
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;bis(9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole)
CID 161012876
3,6-di(dibenzofuran-2-yl)-9-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 118488387
3,6-di(dibenzofuran-2-yl)-9-[2-[4-(9-phenylcarbazol-4-yl)phenyl]phenyl]carbazole
CID 166037350
3-dibenzofuran-2-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-4-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 163485111

Frequently Asked Questions

What is the IUPAC name of (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine?
The IUPAC name of (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine (CID 145167549) is (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine.
What is the SMILES notation for (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine?
The canonical SMILES for (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine is Nc1cccc2c1/C(=C\Cc1ccc3cc(-c4ccc5c(c4)c4cc(-c6ccc7oc8ccccc8c7c6)ccc4n5-c4ccccc4)ccc3c1)c1ccccc1-2.
What is the InChIKey of (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine?
The InChIKey is VIZNEBJATGNHOY-HSRNTDFQSA-N. The full InChI is InChI=1S/C55H36N2O/c56-50-15-8-14-45-42-11-4-5-12-43(42)46(55(45)50)25-18-34-17-19-36-30-37(21-20-35(36)29-34)38-22-26-51-47(31-38)48-32-39(23-27-52(48)57(51)41-9-2-1-3-10-41)40-24-28-54-49(33-40)44-13-6-7-16-53(44)58-54/h1-17,19-33H,18,56H2/b46-25-.
What are the key properties of (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine?
(9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine has a molecular weight of 740.91 g/mol, XLogP of 14.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (9Z)-9-[2-[6-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)naphthalen-2-yl]ethylidene]fluoren-1-amine is sourced from PubChem (CID 145167549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).