3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline

C132H92N2 — CID 170114098

IUPAC3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
SMILESCC1(c2ccccc2)c2ccccc2-c2c(-c3cccc(N(c4ccc(-c5ccc(-c6ccc7ccccc7c6)cc5)cc4)c4ccc(-c5ccccc5-c5cccc(-c6ccc(C7(C)c8ccccc8-c8c(-c9cccc(N(c%10ccc(-c%11ccc(-c%12ccc%13ccccc%13c%12)cc%11)cc%10)c%10ccc(-c%11cccc(-c%12ccccc%12)c%11)cc%10)c9)cccc87)cc6)c5)cc4)c3)cccc21
InChIInChI=1S/C132H92N2/c1-131(111-37-7-4-8-38-111)125-47-17-15-43-123(125)129-121(45-23-49-127(129)131)109-35-22-40-118(88-109)134(114-77-67-95(68-78-114)93-53-57-97(58-54-93)107-62-60-91-28-10-12-30-102(91)85-107)116-81-71-100(72-82-116)119-41-13-14-42-120(119)108-34-20-33-105(86-108)98-63-73-112(74-64-98)132(2)126-48-18-16-44-124(126)130-122(46-24-50-128(130)132)110-36-21-39-117(87-110)133(115-79-69-99(70-80-115)104-32-19-31-103(83-104)89-25-5-3-6-26-89)113-75-65-94(66-76-113)92-51-55-96(56-52-92)106-61-59-90-27-9-11-29-101(90)84-106/h3-88H,1-2H3
InChIKeyJASIWSZZCICXEQ-UHFFFAOYSA-N
MW1706.20 g/mol
LogP35.94
Rot. Bonds19

About 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline

3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline (PubChem CID 170114098) has the molecular formula C132H92N2 and a molecular weight of 1706.20 g/mol. Its IUPAC name is 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound Name3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
PubChem CID170114098
Molecular FormulaC132H92N2
Molecular Weight1706.20 g/mol
Exact Mass1704.73
IUPAC Name3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
SMILESCC1(c2ccccc2)c2ccccc2-c2c(-c3cccc(N(c4ccc(-c5ccc(-c6ccc7ccccc7c6)cc5)cc4)c4ccc(-c5ccccc5-c5cccc(-c6ccc(C7(C)c8ccccc8-c8c(-c9cccc(N(c%10ccc(-c%11ccc(-c%12ccc%13ccccc%13c%12)cc%11)cc%10)c%10ccc(-c%11cccc(-c%12ccccc%12)c%11)cc%10)c9)cccc87)cc6)c5)cc4)c3)cccc21
InChIInChI=1S/C132H92N2/c1-131(111-37-7-4-8-38-111)125-47-17-15-43-123(125)129-121(45-23-49-127(129)131)109-35-22-40-118(88-109)134(114-77-67-95(68-78-114)93-53-57-97(58-54-93)107-62-60-91-28-10-12-30-102(91)85-107)116-81-71-100(72-82-116)119-41-13-14-42-120(119)108-34-20-33-105(86-108)98-63-73-112(74-64-98)132(2)126-48-18-16-44-124(126)130-122(46-24-50-128(130)132)110-36-21-39-117(87-110)133(115-79-69-99(70-80-115)104-32-19-31-103(83-104)89-25-5-3-6-26-89)113-75-65-94(66-76-113)92-51-55-96(56-52-92)106-61-59-90-27-9-11-29-101(90)84-106/h3-88H,1-2H3
InChIKeyJASIWSZZCICXEQ-UHFFFAOYSA-N
XLogP35.94
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms134
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001706.20
LogP ≤ 535.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline with MolForge

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Related Compounds

N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-2-amine
CID 169020514
3-(9-methyl-9-phenylfluoren-4-yl)-N-(4-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 169019619
N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)naphthalen-2-amine
CID 169019826
N-[4-(9-methyl-9-phenylfluoren-4-yl)phenyl]-3-(4-naphthalen-1-ylphenyl)-N-[3-(3-phenylphenyl)phenyl]aniline
CID 169020283
N-[4-(9-methyl-9-phenylfluoren-4-yl)phenyl]-3-(4-naphthalen-1-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 169019655
6-(9-methyl-9-phenylfluoren-4-yl)-N,N-bis(4-naphthalen-1-ylphenyl)naphthalen-2-amine
CID 169019937
9-methyl-N-(4-naphthalen-2-ylphenyl)-9-phenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169019936
N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-3-(4-naphthalen-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 169020066
9-methyl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169020008
2-(9-methyl-9-phenylfluoren-4-yl)-N-(4-naphthalen-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 169019481
N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]-3-(4-phenylphenyl)aniline
CID 169020035
9-methyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169020477

Frequently Asked Questions

What is the IUPAC name of 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline?
The IUPAC name of 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline (CID 170114098) is 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline.
What is the SMILES notation for 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline?
The canonical SMILES for 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline is CC1(c2ccccc2)c2ccccc2-c2c(-c3cccc(N(c4ccc(-c5ccc(-c6ccc7ccccc7c6)cc5)cc4)c4ccc(-c5ccccc5-c5cccc(-c6ccc(C7(C)c8ccccc8-c8c(-c9cccc(N(c%10ccc(-c%11ccc(-c%12ccc%13ccccc%13c%12)cc%11)cc%10)c%10ccc(-c%11cccc(-c%12ccccc%12)c%11)cc%10)c9)cccc87)cc6)c5)cc4)c3)cccc21.
What is the InChIKey of 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline?
The InChIKey is JASIWSZZCICXEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C132H92N2/c1-131(111-37-7-4-8-38-111)125-47-17-15-43-123(125)129-121(45-23-49-127(129)131)109-35-22-40-118(88-109)134(114-77-67-95(68-78-114)93-53-57-97(58-54-93)107-62-60-91-28-10-12-30-102(91)85-107)116-81-71-100(72-82-116)119-41-13-14-42-120(119)108-34-20-33-105(86-108)98-63-73-112(74-64-98)132(2)126-48-18-16-44-124(126)130-122(46-24-50-128(130)132)110-36-21-39-117(87-110)133(115-79-69-99(70-80-115)104-32-19-31-103(83-104)89-25-5-3-6-26-89)113-75-65-94(66-76-113)92-51-55-96(56-52-92)106-61-59-90-27-9-11-29-101(90)84-106/h3-88H,1-2H3.
What are the key properties of 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline?
3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline has a molecular weight of 1706.20 g/mol, XLogP of 35.94, 19 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-methyl-9-[4-[3-[2-[4-[N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)anilino]phenyl]phenyl]phenyl]phenyl]fluoren-4-yl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 170114098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).