N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine

C67H49N — CID 155181916

IUPACN-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine
SMILESCc1cc(-c2ccc3ccccc3c2)cc(-c2cccc3ccccc23)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2
InChIInChI=1S/C67H49N/c1-44-39-49(48-34-33-45-19-10-11-21-47(45)40-48)41-60(55-30-18-22-46-20-12-13-27-54(46)55)65(44)68(52-35-37-58-56-28-14-16-31-61(56)66(2,3)63(58)42-52)53-36-38-59-57-29-15-17-32-62(57)67(64(59)43-53,50-23-6-4-7-24-50)51-25-8-5-9-26-51/h4-43H,1-3H3
InChIKeyXSEUCMQPJAXZPT-UHFFFAOYSA-N
MW868.14 g/mol
LogP17.77
Rot. Bonds7

About N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine

N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine (PubChem CID 155181916) has the molecular formula C67H49N and a molecular weight of 868.14 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine
PubChem CID155181916
Molecular FormulaC67H49N
Molecular Weight868.14 g/mol
Exact Mass867.39
IUPAC NameN-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine
SMILESCc1cc(-c2ccc3ccccc3c2)cc(-c2cccc3ccccc23)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2
InChIInChI=1S/C67H49N/c1-44-39-49(48-34-33-45-19-10-11-21-47(45)40-48)41-60(55-30-18-22-46-20-12-13-27-54(46)55)65(44)68(52-35-37-58-56-28-14-16-31-61(56)66(2,3)63(58)42-52)53-36-38-59-57-29-15-17-32-62(57)67(64(59)43-53,50-23-6-4-7-24-50)51-25-8-5-9-26-51/h4-43H,1-3H3
InChIKeyXSEUCMQPJAXZPT-UHFFFAOYSA-N
XLogP17.77
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500868.14
LogP ≤ 517.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 155623469
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-naphthalen-1-yl-6-naphthalen-2-ylphenyl)fluoren-2-amine
CID 146579364
9,9-dimethyl-N-(2-methyl-4-naphthalen-2-yl-6-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)fluoren-2-amine
CID 155221008
7-[4-[4-[bis(9,9-dimethylfluoren-2-yl)amino]-3-naphthalen-2-ylphenyl]naphthalen-2-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-naphthalen-1-yl-6-naphthalen-2-ylphenyl)fluoren-2-amine
CID 155181726
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenylfluoren-2-amine
CID 166565951
N,N-bis(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(9-methyl-9-phenylfluoren-2-yl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)fluoren-2-amine
CID 157319192
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-(7-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(7-phenylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(7-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine;N,9,9-triphenyl-N-[4-(7-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 160929151
N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-yl-6,9,9-triphenylfluoren-2-amine;N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-2-yl-6,9,9-triphenylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 157391527
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-naphthalen-1-yl-2-phenylphenyl)fluoren-2-amine
CID 155181598
N,N-bis(4-phenanthren-2-ylphenyl)triphenylen-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenanthren-2-ylphenyl)phenanthren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-(4-phenanthren-2-ylphenyl)phenanthren-2-amine;N-[4-(3,5-diphenylphenyl)phenyl]-4-phenanthren-2-yl-N-(4-phenanthren-2-ylphenyl)aniline
CID 163978822
9,9-dimethyl-N-(2-methyl-4-naphthalen-1-yl-6-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 155221158
N-(9,9-dimethylfluoren-2-yl)-7-[7-[4-[(9,9-diphenylfluoren-2-yl)-phenanthren-2-ylamino]phenyl]phenanthren-1-yl]-N-(4-phenanthren-2-ylphenyl)phenanthren-2-amine
CID 166732688

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine?
The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine (CID 155181916) is N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine is Cc1cc(-c2ccc3ccccc3c2)cc(-c2cccc3ccccc23)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.
What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine?
The InChIKey is XSEUCMQPJAXZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H49N/c1-44-39-49(48-34-33-45-19-10-11-21-47(45)40-48)41-60(55-30-18-22-46-20-12-13-27-54(46)55)65(44)68(52-35-37-58-56-28-14-16-31-61(56)66(2,3)63(58)42-52)53-36-38-59-57-29-15-17-32-62(57)67(64(59)43-53,50-23-6-4-7-24-50)51-25-8-5-9-26-51/h4-43H,1-3H3.
What are the key properties of N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine?
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine has a molecular weight of 868.14 g/mol, XLogP of 17.77, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-6-naphthalen-1-yl-4-naphthalen-2-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 155181916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).