9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine

C74H67N — CID 177067004

IUPAC9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine
SMILESCc1cc(C)cc(-c2c(C)cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccc(C(C)(C)C)cc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccc(C(C)(C)C)cc3)c3ccccc3-4)cc2C)c1
InChIInChI=1S/C74H67N/c1-48-41-49(2)43-52(42-48)70-50(3)44-61(45-51(70)4)75(59-37-39-64-62-25-17-19-27-66(62)73(68(64)46-59,55-21-13-11-14-22-55)57-33-29-53(30-34-57)71(5,6)7)60-38-40-65-63-26-18-20-28-67(63)74(69(65)47-60,56-23-15-12-16-24-56)58-35-31-54(32-36-58)72(8,9)10/h11-47H,1-10H3
InChIKeyRLTYOALDJKJLLZ-UHFFFAOYSA-N
MW970.36 g/mol
LogP19.38
Rot. Bonds8

About 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine

9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine (PubChem CID 177067004) has the molecular formula C74H67N and a molecular weight of 970.36 g/mol. Its IUPAC name is 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine.

Molecular Properties

Compound Name9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine
PubChem CID177067004
Molecular FormulaC74H67N
Molecular Weight970.36 g/mol
Exact Mass969.53
IUPAC Name9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine
SMILESCc1cc(C)cc(-c2c(C)cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccc(C(C)(C)C)cc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccc(C(C)(C)C)cc3)c3ccccc3-4)cc2C)c1
InChIInChI=1S/C74H67N/c1-48-41-49(2)43-52(42-48)70-50(3)44-61(45-51(70)4)75(59-37-39-64-62-25-17-19-27-66(62)73(68(64)46-59,55-21-13-11-14-22-55)57-33-29-53(30-34-57)71(5,6)7)60-38-40-65-63-26-18-20-28-67(63)74(69(65)47-60,56-23-15-12-16-24-56)58-35-31-54(32-36-58)72(8,9)10/h11-47H,1-10H3
InChIKeyRLTYOALDJKJLLZ-UHFFFAOYSA-N
XLogP19.38
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms75
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500970.36
LogP ≤ 519.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,9-bis(4-tert-butylphenyl)-N-[9-(3,5-dimethylphenyl)-9-phenylfluoren-2-yl]-N-phenylfluoren-2-amine
CID 177067384
9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 177067003
N-(4-tert-butylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine;N-(4-fluorophenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine;N-(4-methylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 162199344
N-(4-methylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381203
N-[9,9-bis(4-tert-butylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9,9-bis(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 158846091
6-tert-butyl-9,9-bis(4-tert-butylphenyl)-N-(9,9-diphenylfluoren-2-yl)-N-(3-phenylphenyl)fluoren-2-amine
CID 176622694
N-[9,9-bis(4-tert-butylphenyl)fluoren-2-yl]-2-tert-butyl-N-(3-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine
CID 177067157
N-[9,9-bis(4-tert-butylphenyl)fluoren-2-yl]-2,7,7'-tritert-butyl-N-(3-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine
CID 177066973
9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-(4-fluorophenyl)fluoren-2-yl]-N,9-diphenylfluoren-2-amine
CID 177067286
N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)-9-(4-propan-2-ylphenyl)fluoren-2-amine
CID 177067063
9-(4-methylphenyl)-N-[9-(4-methylphenyl)-9-phenylfluoren-3-yl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 177067075
N-[4-(4-tert-butylphenyl)phenyl]-9-(4-methylphenyl)-N-[9-(4-methylphenyl)-9-(4-phenylphenyl)fluoren-2-yl]-9-phenylfluoren-1-amine
CID 177066968

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine?
The IUPAC name of 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine (CID 177067004) is 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine.
What is the SMILES notation for 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine?
The canonical SMILES for 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine is Cc1cc(C)cc(-c2c(C)cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccc(C(C)(C)C)cc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccc(C(C)(C)C)cc3)c3ccccc3-4)cc2C)c1.
What is the InChIKey of 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine?
The InChIKey is RLTYOALDJKJLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H67N/c1-48-41-49(2)43-52(42-48)70-50(3)44-61(45-51(70)4)75(59-37-39-64-62-25-17-19-27-66(62)73(68(64)46-59,55-21-13-11-14-22-55)57-33-29-53(30-34-57)71(5,6)7)60-38-40-65-63-26-18-20-28-67(63)74(69(65)47-60,56-23-15-12-16-24-56)58-35-31-54(32-36-58)72(8,9)10/h11-47H,1-10H3.
What are the key properties of 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine?
9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine has a molecular weight of 970.36 g/mol, XLogP of 19.38, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-N-[4-(3,5-dimethylphenyl)-3,5-dimethylphenyl]-9-phenylfluoren-2-amine is sourced from PubChem (CID 177067004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).