7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile

C106H70N8 — CID 138750115

IUPAC7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile
SMILESCC1(C)c2cc(C#N)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccc(-c9nc(-c%10ccccc%10)nc(-c%10ccc(-c%11ccc(-c%12ccc(-c%13ccc%14c(c%13)C(C)(C)c%13cccc(C#N)c%13-%14)cc%12)c%12ccccc%11%12)cc%10)n9)cc8)cc7)n6)cc5)c5ccccc45)cc3)cc21
InChIInChI=1S/C106H70N8/c1-105(2)94-25-15-20-82(64-108)98(94)93-55-52-81(62-97(93)105)69-29-37-71(38-30-69)84-57-59-86(90-24-14-12-22-88(84)90)73-41-49-79(50-42-73)104-112-100(75-18-9-6-10-19-75)110-102(114-104)77-45-33-67(34-46-77)66-31-43-76(44-32-66)101-109-99(74-16-7-5-8-17-74)111-103(113-101)78-47-39-72(40-48-78)85-58-56-83(87-21-11-13-23-89(85)87)70-35-27-68(28-36-70)80-51-54-92-91-53-26-65(63-107)60-95(91)106(3,4)96(92)61-80/h5-62H,1-4H3
InChIKeyHVWPZPNSRCIYDX-UHFFFAOYSA-N
MW1455.78 g/mol
LogP26.39
Rot. Bonds13

About 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile

7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile (PubChem CID 138750115) has the molecular formula C106H70N8 and a molecular weight of 1455.78 g/mol. Its IUPAC name is 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile.

Molecular Properties

Compound Name7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile
PubChem CID138750115
Molecular FormulaC106H70N8
Molecular Weight1455.78 g/mol
Exact Mass1454.57
IUPAC Name7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile
SMILESCC1(C)c2cc(C#N)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccc(-c9nc(-c%10ccccc%10)nc(-c%10ccc(-c%11ccc(-c%12ccc(-c%13ccc%14c(c%13)C(C)(C)c%13cccc(C#N)c%13-%14)cc%12)c%12ccccc%11%12)cc%10)n9)cc8)cc7)n6)cc5)c5ccccc45)cc3)cc21
InChIInChI=1S/C106H70N8/c1-105(2)94-25-15-20-82(64-108)98(94)93-55-52-81(62-97(93)105)69-29-37-71(38-30-69)84-57-59-86(90-24-14-12-22-88(84)90)73-41-49-79(50-42-73)104-112-100(75-18-9-6-10-19-75)110-102(114-104)77-45-33-67(34-46-77)66-31-43-76(44-32-66)101-109-99(74-16-7-5-8-17-74)111-103(113-101)78-47-39-72(40-48-78)85-58-56-83(87-21-11-13-23-89(85)87)70-35-27-68(28-36-70)80-51-54-92-91-53-26-65(63-107)60-95(91)106(3,4)96(92)61-80/h5-62H,1-4H3
InChIKeyHVWPZPNSRCIYDX-UHFFFAOYSA-N
XLogP26.39
TPSA124.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms114
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001455.78
LogP ≤ 526.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile?
The IUPAC name of 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile (CID 138750115) is 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile.
What is the SMILES notation for 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile?
The canonical SMILES for 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile is CC1(C)c2cc(C#N)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccc(-c9nc(-c%10ccccc%10)nc(-c%10ccc(-c%11ccc(-c%12ccc(-c%13ccc%14c(c%13)C(C)(C)c%13cccc(C#N)c%13-%14)cc%12)c%12ccccc%11%12)cc%10)n9)cc8)cc7)n6)cc5)c5ccccc45)cc3)cc21.
What is the InChIKey of 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile?
The InChIKey is HVWPZPNSRCIYDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C106H70N8/c1-105(2)94-25-15-20-82(64-108)98(94)93-55-52-81(62-97(93)105)69-29-37-71(38-30-69)84-57-59-86(90-24-14-12-22-88(84)90)73-41-49-79(50-42-73)104-112-100(75-18-9-6-10-19-75)110-102(114-104)77-45-33-67(34-46-77)66-31-43-76(44-32-66)101-109-99(74-16-7-5-8-17-74)111-103(113-101)78-47-39-72(40-48-78)85-58-56-83(87-21-11-13-23-89(85)87)70-35-27-68(28-36-70)80-51-54-92-91-53-26-65(63-107)60-95(91)106(3,4)96(92)61-80/h5-62H,1-4H3.
What are the key properties of 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile?
7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile has a molecular weight of 1455.78 g/mol, XLogP of 26.39, 13 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(7-cyano-9,9-dimethylfluoren-2-yl)phenyl]naphthalen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-9,9-dimethylfluorene-4-carbonitrile is sourced from PubChem (CID 138750115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).