N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine

C120H90N4 — CID 170142819

About N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine

N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine (PubChem CID 170142819) has the molecular formula C120H90N4 and a molecular weight of 1588.07 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine.

Molecular Properties

• Compound Name: N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine
• PubChem CID: 170142819
• Molecular Formula: C120H90N4
• Molecular Weight: 1588.07 g/mol
• Exact Mass: 1586.72
• IUPAC Name: N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine
• SMILES: CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)c3ccc(-c5ccc6c(c5)C(C)(C)c5ccc(-c7cccc(N(c8ccc(-c9ccc%10c(c9)c9ccccc9n%10-c9ccccc9)cc8)c8ccccc8-c8cccc9c8-c8ccccc8C9(C)C)c7)cc5-6)cc3n4-c3ccccc3)c3ccccc3-c3cccc4c3-c3ccccc3C4(C)C)ccc21
• InChI: InChI=1S/C120H90N4/c1-117(2)101-44-21-15-36-87(101)98-73-85(60-65-105(98)117)122(110-50-25-19-38-90(110)94-43-29-48-107-116(94)96-41-17-23-46-103(96)119(107,5)6)86-61-67-113-100(74-86)92-63-55-80(72-114(92)124(113)82-33-13-10-14-34-82)79-54-62-88-97-69-78(56-64-104(97)120(7,8)108(88)71-79)76-30-27-35-84(68-76)121(109-49-24-18-37-89(109)93-42-28-47-106-115(93)95-40-16-22-45-102(95)118(106,3)4)83-58-52-75(53-59-83)77-57-66-112-99(70-77)91-39-20-26-51-111(91)123(112)81-31-11-9-12-32-81/h9-74H,1-8H3
• InChIKey: DACRKCLFNPOXSP-UHFFFAOYSA-N
• XLogP: 32.38
• TPSA: 16.34 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 13
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1588.07
LogP ≤ 5	32.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine?

The IUPAC name of N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine (CID 170142819) is N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine.

What is the SMILES notation for N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine?

The canonical SMILES for N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine is CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)c3ccc(-c5ccc6c(c5)C(C)(C)c5ccc(-c7cccc(N(c8ccc(-c9ccc%10c(c9)c9ccccc9n%10-c9ccccc9)cc8)c8ccccc8-c8cccc9c8-c8ccccc8C9(C)C)c7)cc5-6)cc3n4-c3ccccc3)c3ccccc3-c3cccc4c3-c3ccccc3C4(C)C)ccc21.

What is the InChIKey of N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine?

The InChIKey is DACRKCLFNPOXSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C120H90N4/c1-117(2)101-44-21-15-36-87(101)98-73-85(60-65-105(98)117)122(110-50-25-19-38-90(110)94-43-29-48-107-116(94)96-41-17-23-46-103(96)119(107,5)6)86-61-67-113-100(74-86)92-63-55-80(72-114(92)124(113)82-33-13-10-14-34-82)79-54-62-88-97-69-78(56-64-104(97)120(7,8)108(88)71-79)76-30-27-35-84(68-76)121(109-49-24-18-37-89(109)93-42-28-47-106-115(93)95-40-16-22-45-102(95)118(106,3)4)83-58-52-75(53-59-83)77-57-66-112-99(70-77)91-39-20-26-51-111(91)123(112)81-31-11-9-12-32-81/h9-74H,1-8H3.

What are the key properties of N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine?

N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine has a molecular weight of 1588.07 g/mol, XLogP of 32.38, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine is sourced from PubChem (CID 170142819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).