N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline

C74H52N2 — CID 170112904

IUPACN-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
SMILESCC1(c2ccccc2)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)cc4)c4ccccc4-c4ccccc4-c4ccccc4-c4ccccc4)cc3)cc21
InChIInChI=1S/C74H52N2/c1-74(55-24-7-3-8-25-55)69-37-18-15-32-64(69)65-49-44-54(50-70(65)74)51-40-45-57(46-41-51)75(71-38-19-16-33-66(71)63-31-14-13-30-62(63)61-29-12-11-28-59(61)52-22-5-2-6-23-52)58-47-42-53(43-48-58)60-35-21-36-68-67-34-17-20-39-72(67)76(73(60)68)56-26-9-4-10-27-56/h2-50H,1H3
InChIKeyWQTNSYQHNCXTAD-UHFFFAOYSA-N
MW969.24 g/mol
LogP19.92
Rot. Bonds10

About N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline

N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline (PubChem CID 170112904) has the molecular formula C74H52N2 and a molecular weight of 969.24 g/mol. Its IUPAC name is N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound NameN-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
PubChem CID170112904
Molecular FormulaC74H52N2
Molecular Weight969.24 g/mol
Exact Mass968.41
IUPAC NameN-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
SMILESCC1(c2ccccc2)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)cc4)c4ccccc4-c4ccccc4-c4ccccc4-c4ccccc4)cc3)cc21
InChIInChI=1S/C74H52N2/c1-74(55-24-7-3-8-25-55)69-37-18-15-32-64(69)65-49-44-54(50-70(65)74)51-40-45-57(46-41-51)75(71-38-19-16-33-66(71)63-31-14-13-30-62(63)61-29-12-11-28-59(61)52-22-5-2-6-23-52)58-47-42-53(43-48-58)60-35-21-36-68-67-34-17-20-39-72(67)76(73(60)68)56-26-9-4-10-27-56/h2-50H,1H3
InChIKeyWQTNSYQHNCXTAD-UHFFFAOYSA-N
XLogP19.92
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500969.24
LogP ≤ 519.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline 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

N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine
CID 170119206
2-(8-cyclohexylnaphthalen-1-yl)-N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]aniline
CID 170304496
N-[4-(9-methyl-9-phenylfluoren-4-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170304295
9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(2-phenylphenyl)fluoren-2-amine
CID 177080212
N-[3-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]-N-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)aniline
CID 170112827
9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 168790284
N-(3-carbazol-9-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
CID 170112907
3-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-2-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]aniline
CID 170666044
9-methyl-9-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170304175
9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]-N-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)carbazol-1-amine
CID 170118881
N-(4-carbazol-9-ylphenyl)-N-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
CID 170112713
N-[4-(9-methylfluoren-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
CID 129293021

Frequently Asked Questions

What is the IUPAC name of N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline?
The IUPAC name of N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline (CID 170112904) is N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline.
What is the SMILES notation for N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline?
The canonical SMILES for N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline is CC1(c2ccccc2)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)cc4)c4ccccc4-c4ccccc4-c4ccccc4-c4ccccc4)cc3)cc21.
What is the InChIKey of N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline?
The InChIKey is WQTNSYQHNCXTAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H52N2/c1-74(55-24-7-3-8-25-55)69-37-18-15-32-64(69)65-49-44-54(50-70(65)74)51-40-45-57(46-41-51)75(71-38-19-16-33-66(71)63-31-14-13-30-62(63)61-29-12-11-28-59(61)52-22-5-2-6-23-52)58-47-42-53(43-48-58)60-35-21-36-68-67-34-17-20-39-72(67)76(73(60)68)56-26-9-4-10-27-56/h2-50H,1H3.
What are the key properties of N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline?
N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline has a molecular weight of 969.24 g/mol, XLogP of 19.92, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 170112904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).