N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine

C58H43N — CID 171453475

IUPACN-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2cc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)-c3ccccc3C4(C)c3ccccc3)ccc21
InChIInChI=1S/C58H43N/c1-57(44-23-11-5-12-24-44)53-29-17-15-27-49(53)51-38-46(31-33-55(51)57)59(48-36-42(40-19-7-3-8-20-40)35-43(37-48)41-21-9-4-10-22-41)47-32-34-56-52(39-47)50-28-16-18-30-54(50)58(56,2)45-25-13-6-14-26-45/h3-39H,1-2H3
InChIKeyLUUHHWBTBZTGPH-UHFFFAOYSA-N
MW753.99 g/mol
LogP15.16
Rot. Bonds7

About N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine

N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine (PubChem CID 171453475) has the molecular formula C58H43N and a molecular weight of 753.99 g/mol. Its IUPAC name is N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine.

Molecular Properties

Compound NameN-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine
PubChem CID171453475
Molecular FormulaC58H43N
Molecular Weight753.99 g/mol
Exact Mass753.34
IUPAC NameN-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2cc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)-c3ccccc3C4(C)c3ccccc3)ccc21
InChIInChI=1S/C58H43N/c1-57(44-23-11-5-12-24-44)53-29-17-15-27-49(53)51-38-46(31-33-55(51)57)59(48-36-42(40-19-7-3-8-20-40)35-43(37-48)41-21-9-4-10-22-41)47-32-34-56-52(39-47)50-28-16-18-30-54(50)58(56,2)45-25-13-6-14-26-45/h3-39H,1-2H3
InChIKeyLUUHHWBTBZTGPH-UHFFFAOYSA-N
XLogP15.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500753.99
LogP ≤ 515.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,5-diphenylphenyl)-N-(9-methyl-9-phenylfluoren-3-yl)-9,10-diphenylphenanthren-2-amine
CID 169063795
9-methyl-N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 171453321
N-(3-chloro-5-phenylphenyl)-N-(9,9-dimethylfluoren-3-yl)-9,9-dimethylfluoren-3-amine
CID 167133358
N-(9,9-diphenylfluoren-3-yl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9'-spirobi[fluorene]-3-amine
CID 121423858
N,N-bis(9-methyl-9-phenylfluoren-3-yl)-10-phenylphenanthren-9-amine
CID 171453114
N-(3,5-diphenylphenyl)-9-methyl-9-phenyl-N-(4-phenylphenyl)fluoren-4-amine
CID 118188510
N-[4-(3,5-diphenylphenyl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-3-amine
CID 166663853
9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-3-amine
CID 121285785
N-[3-(9,10-diphenylphenanthren-2-yl)phenyl]-9-methyl-N,9-diphenylfluoren-3-amine
CID 169063655
9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine;N-(9,9-diphenylfluoren-3-yl)-9-methyl-9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 158414467
N-(9-methyl-9-phenylfluoren-2-yl)-N-(4-phenylphenyl)triphenylen-2-amine
CID 137467192
N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 118298464

Frequently Asked Questions

What is the IUPAC name of N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine?
The IUPAC name of N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine (CID 171453475) is N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine.
What is the SMILES notation for N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine?
The canonical SMILES for N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine is CC1(c2ccccc2)c2ccccc2-c2cc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)-c3ccccc3C4(C)c3ccccc3)ccc21.
What is the InChIKey of N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine?
The InChIKey is LUUHHWBTBZTGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H43N/c1-57(44-23-11-5-12-24-44)53-29-17-15-27-49(53)51-38-46(31-33-55(51)57)59(48-36-42(40-19-7-3-8-20-40)35-43(37-48)41-21-9-4-10-22-41)47-32-34-56-52(39-47)50-28-16-18-30-54(50)58(56,2)45-25-13-6-14-26-45/h3-39H,1-2H3.
What are the key properties of N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine?
N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine has a molecular weight of 753.99 g/mol, XLogP of 15.16, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-diphenylphenyl)-9-methyl-N-(9-methyl-9-phenylfluoren-3-yl)-9-phenylfluoren-3-amine is sourced from PubChem (CID 171453475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).