N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine

C76H60N2 — CID 121323104

IUPACN-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine
SMILESCc1cc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc3-c3cccc4ccccc34)c(C)c2)ccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccccc1-c1cccc2ccccc12
InChIInChI=1S/C76H60N2/c1-49-45-53(37-43-71(49)77(55-39-41-63-61-27-11-15-33-67(61)75(3,4)69(63)47-55)73-35-17-13-29-65(73)59-31-19-23-51-21-7-9-25-57(51)59)54-38-44-72(50(2)46-54)78(56-40-42-64-62-28-12-16-34-68(62)76(5,6)70(64)48-56)74-36-18-14-30-66(74)60-32-20-24-52-22-8-10-26-58(52)60/h7-48H,1-6H3
InChIKeyAZJWNXHEYXFFSX-UHFFFAOYSA-N
MW1001.33 g/mol
LogP21.16
Rot. Bonds9

About N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine

N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine (PubChem CID 121323104) has the molecular formula C76H60N2 and a molecular weight of 1001.33 g/mol. Its IUPAC name is N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine
PubChem CID121323104
Molecular FormulaC76H60N2
Molecular Weight1001.33 g/mol
Exact Mass1000.48
IUPAC NameN-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine
SMILESCc1cc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc3-c3cccc4ccccc34)c(C)c2)ccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccccc1-c1cccc2ccccc12
InChIInChI=1S/C76H60N2/c1-49-45-53(37-43-71(49)77(55-39-41-63-61-27-11-15-33-67(61)75(3,4)69(63)47-55)73-35-17-13-29-65(73)59-31-19-23-51-21-7-9-25-57(51)59)54-38-44-72(50(2)46-54)78(56-40-42-64-62-28-12-16-34-68(62)76(5,6)70(64)48-56)74-36-18-14-30-66(74)60-32-20-24-52-22-8-10-26-58(52)60/h7-48H,1-6H3
InChIKeyAZJWNXHEYXFFSX-UHFFFAOYSA-N
XLogP21.16
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001001.33
LogP ≤ 521.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine with MolForge

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-methylphenyl)-2-naphthalen-1-ylphenyl]fluoren-2-amine
CID 146579363
N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)fluoren-2-amine
CID 121323170
N-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-(2-methyl-4-naphthalen-2-ylphenyl)fluoren-2-amine
CID 155181614
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-methyl-4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 155220981
9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
CID 164774638
4-[4-[4-(9,9-diphenylfluoren-2-yl)-N-(2-naphthalen-1-ylphenyl)anilino]-3-methylphenyl]-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-2-methyl-N-(2-naphthalen-1-ylphenyl)aniline
CID 121323130
9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine
CID 170538805
N-(9,9-dimethylfluoren-2-yl)-N-(2-naphthalen-1-yl-4-phenylphenyl)phenanthren-9-amine
CID 155181855
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
CID 58983323
N-(9,9-dimethylfluoren-2-yl)-3-(2-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)triphenylen-2-amine
CID 177294607
9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(2-phenylphenyl)fluoren-2-amine
CID 164774447
9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 155623469

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine?
The IUPAC name of N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine (CID 121323104) is N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine.
What is the SMILES notation for N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine?
The canonical SMILES for N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine is Cc1cc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc3-c3cccc4ccccc34)c(C)c2)ccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccccc1-c1cccc2ccccc12.
What is the InChIKey of N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine?
The InChIKey is AZJWNXHEYXFFSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H60N2/c1-49-45-53(37-43-71(49)77(55-39-41-63-61-27-11-15-33-67(61)75(3,4)69(63)47-55)73-35-17-13-29-65(73)59-31-19-23-51-21-7-9-25-57(51)59)54-38-44-72(50(2)46-54)78(56-40-42-64-62-28-12-16-34-68(62)76(5,6)70(64)48-56)74-36-18-14-30-66(74)60-32-20-24-52-22-8-10-26-58(52)60/h7-48H,1-6H3.
What are the key properties of N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine?
N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine has a molecular weight of 1001.33 g/mol, XLogP of 21.16, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 121323104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).