N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline

C116H74N4O2 — CID 155398691

About N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline

N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline (PubChem CID 155398691) has the molecular formula C116H74N4O2 and a molecular weight of 1555.89 g/mol. Its IUPAC name is N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline.

Molecular Properties

• Compound Name: N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline
• PubChem CID: 155398691
• Molecular Formula: C116H74N4O2
• Molecular Weight: 1555.89 g/mol
• Exact Mass: 1554.58
• IUPAC Name: N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline
• SMILES: c1cc(-c2cccc3oc4ccccc4c23)cc(N(c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc2)c2ccc(-c3cccc4cc(-c5ccc6c7ccccc7n(-c7ccccc7-c7ccc(N(c8cccc(-c9cccc%10oc%11ccccc%11c9%10)c8)c8ccccc8-c8ccc9ccccc9c8)cc7)c6c5)ccc34)cc2)c1
• InChI: InChI=1S/C116H74N4O2/c1-2-25-79-70-85(53-52-75(79)24-1)95-33-5-11-42-104(95)118(90-30-20-27-84(73-90)97-41-23-51-114-116(97)103-38-10-18-49-112(103)122-114)88-66-58-78(59-67-88)94-32-4-13-44-106(94)120-109-47-16-8-36-100(109)101-69-61-81(74-110(101)120)80-60-68-92-82(71-80)28-21-39-91(92)76-54-62-86(63-55-76)117(89-29-19-26-83(72-89)96-40-22-50-113-115(96)102-37-9-17-48-111(102)121-113)87-64-56-77(57-65-87)93-31-3-12-43-105(93)119-107-45-14-6-34-98(107)99-35-7-15-46-108(99)119/h1-74H
• InChIKey: MMMQSGIXDUGAHL-UHFFFAOYSA-N
• XLogP: 32.59
• TPSA: 42.62 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 15
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1555.89
LogP ≤ 5	32.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline?

The IUPAC name of N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline (CID 155398691) is N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline.

What is the SMILES notation for N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline?

The canonical SMILES for N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline is c1cc(-c2cccc3oc4ccccc4c23)cc(N(c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc2)c2ccc(-c3cccc4cc(-c5ccc6c7ccccc7n(-c7ccccc7-c7ccc(N(c8cccc(-c9cccc%10oc%11ccccc%11c9%10)c8)c8ccccc8-c8ccc9ccccc9c8)cc7)c6c5)ccc34)cc2)c1.

What is the InChIKey of N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline?

The InChIKey is MMMQSGIXDUGAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C116H74N4O2/c1-2-25-79-70-85(53-52-75(79)24-1)95-33-5-11-42-104(95)118(90-30-20-27-84(73-90)97-41-23-51-114-116(97)103-38-10-18-49-112(103)122-114)88-66-58-78(59-67-88)94-32-4-13-44-106(94)120-109-47-16-8-36-100(109)101-69-61-81(74-110(101)120)80-60-68-92-82(71-80)28-21-39-91(92)76-54-62-86(63-55-76)117(89-29-19-26-83(72-89)96-40-22-50-113-115(96)102-37-9-17-48-111(102)121-113)87-64-56-77(57-65-87)93-31-3-12-43-105(93)119-107-45-14-6-34-98(107)99-35-7-15-46-108(99)119/h1-74H.

What are the key properties of N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline?

N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline has a molecular weight of 1555.89 g/mol, XLogP of 32.59, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[2-[2-[5-[4-[4-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)anilino]phenyl]naphthalen-2-yl]carbazol-9-yl]phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-naphthalen-2-ylaniline is sourced from PubChem (CID 155398691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).