N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine

C64H47N — CID 163731251

IUPACN-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3-c3ccccc3)c3cccc4c3C(c3ccccc3)(c3ccc(-c5ccccc5)cc3)c3ccccc3-4)cc21
InChIInChI=1S/C64H47N/c1-63(2)57-31-17-15-28-52(57)54-40-39-51(43-59(54)63)65(60-41-36-48(45-22-9-4-10-23-45)42-56(60)47-24-11-5-12-25-47)61-33-19-30-55-53-29-16-18-32-58(53)64(62(55)61,49-26-13-6-14-27-49)50-37-34-46(35-38-50)44-20-7-3-8-21-44/h3-43H,1-2H3
InChIKeyBWKYQAVMAATQQH-UHFFFAOYSA-N
MW830.09 g/mol
LogP16.83
Rot. Bonds8

About N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine

N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine (PubChem CID 163731251) has the molecular formula C64H47N and a molecular weight of 830.09 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine
PubChem CID163731251
Molecular FormulaC64H47N
Molecular Weight830.09 g/mol
Exact Mass829.37
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3-c3ccccc3)c3cccc4c3C(c3ccccc3)(c3ccc(-c5ccccc5)cc3)c3ccccc3-4)cc21
InChIInChI=1S/C64H47N/c1-63(2)57-31-17-15-28-52(57)54-40-39-51(43-59(54)63)65(60-41-36-48(45-22-9-4-10-23-45)42-56(60)47-24-11-5-12-25-47)61-33-19-30-55-53-29-16-18-32-58(53)64(62(55)61,49-26-13-6-14-27-49)50-37-34-46(35-38-50)44-20-7-3-8-21-44/h3-43H,1-2H3
InChIKeyBWKYQAVMAATQQH-UHFFFAOYSA-N
XLogP16.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500830.09
LogP ≤ 516.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine with MolForge

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Related Compounds

N-[4-[4-[4-[4-[(9,9-dimethylfluoren-2-yl)-(9,9'-spirobi[fluorene]-1-yl)amino]phenyl]phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-1-amine
CID 155005492
9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]-N-[2-phenyl-4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 155221094
1-[4-(N-(9,9-dimethylfluoren-2-yl)-2,4-diphenylanilino)phenyl]-9,9-diphenylfluoren-4-ol
CID 122607155
N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 159265679
N-[2-[9,9-diphenyl-8-(4-phenylphenyl)fluoren-2-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 155153846
4-N-(9,9-dimethylfluoren-2-yl)-1-N-(9,9-diphenylfluoren-2-yl)-1-N,4-N-bis(2-phenylphenyl)-2-(9,9'-spirobi[fluorene]-2-yl)benzene-1,4-diamine
CID 121361277
9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine
CID 159519598
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
CID 121285751
N-(2,4-diphenylphenyl)-9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)fluoren-2-amine
CID 140919885
N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 134487972
N-(9,9-dimethylfluoren-2-yl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9'-spirobi[fluorene]-1-amine
CID 168750038
N-[7-[3-[3-[2-(N-[9,9-dimethyl-7-[4-(4-phenylphenyl)phenyl]fluoren-2-yl]-2-phenylanilino)-9-phenylfluoren-9-yl]phenyl]phenyl]-9,9-diphenylfluoren-2-yl]-9,9-dimethyl-N-(2-phenylphenyl)-7-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 139469384

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine (CID 163731251) is N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3-c3ccccc3)c3cccc4c3C(c3ccccc3)(c3ccc(-c5ccccc5)cc3)c3ccccc3-4)cc21.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine?
The InChIKey is BWKYQAVMAATQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H47N/c1-63(2)57-31-17-15-28-52(57)54-40-39-51(43-59(54)63)65(60-41-36-48(45-22-9-4-10-23-45)42-56(60)47-24-11-5-12-25-47)61-33-19-30-55-53-29-16-18-32-58(53)64(62(55)61,49-26-13-6-14-27-49)50-37-34-46(35-38-50)44-20-7-3-8-21-44/h3-43H,1-2H3.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine?
N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine has a molecular weight of 830.09 g/mol, XLogP of 16.83, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-N-(2,4-diphenylphenyl)-9-phenyl-9-(4-phenylphenyl)fluoren-1-amine is sourced from PubChem (CID 163731251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).