N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine

C55H38N2 — CID 145232650

IUPACN-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc(N(c7ccccc7)c7ccc8c(c7)-c7ccccc7C8)cc6)c5)ccc43)cc2)cc1
InChIInChI=1S/C55H38N2/c1-3-12-38(13-4-1)39-22-30-48(31-23-39)57-54-21-10-9-20-51(54)53-36-43(27-33-55(53)57)42-16-11-15-41(34-42)40-24-28-47(29-25-40)56(46-17-5-2-6-18-46)49-32-26-45-35-44-14-7-8-19-50(44)52(45)37-49/h1-34,36-37H,35H2
InChIKeyHCGPZEKIWQMJOB-UHFFFAOYSA-N
MW726.92 g/mol
LogP14.83
Rot. Bonds7

About N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine

N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine (PubChem CID 145232650) has the molecular formula C55H38N2 and a molecular weight of 726.92 g/mol. Its IUPAC name is N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine.

Molecular Properties

Compound NameN-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine
PubChem CID145232650
Molecular FormulaC55H38N2
Molecular Weight726.92 g/mol
Exact Mass726.30
IUPAC NameN-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc(N(c7ccccc7)c7ccc8c(c7)-c7ccccc7C8)cc6)c5)ccc43)cc2)cc1
InChIInChI=1S/C55H38N2/c1-3-12-38(13-4-1)39-22-30-48(31-23-39)57-54-21-10-9-20-51(54)53-36-43(27-33-55(53)57)42-16-11-15-41(34-42)40-24-28-47(29-25-40)56(46-17-5-2-6-18-46)49-32-26-45-35-44-14-7-8-19-50(44)52(45)37-49/h1-34,36-37H,35H2
InChIKeyHCGPZEKIWQMJOB-UHFFFAOYSA-N
XLogP14.83
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.92
LogP ≤ 514.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine
CID 164973496
N-[4-[4-(3-phenylcarbazol-9-yl)phenyl]phenyl]-3-(4-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]aniline
CID 121312772
N-(4-carbazol-9-ylphenyl)-N-[4-(5-pentacyclo[14.7.1.03,8.09,14.020,24]tetracosa-1(23),3(8),4,6,9,11,13,16,18,20(24),21-undecaenyl)phenyl]-4-phenylaniline
CID 129095714
4-phenyl-N-[4-[3-[4-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 90185795
4-bromo-N,N-diphenylaniline;N,N-diphenyl-4-[3-(10-phenylanthracen-9-yl)carbazol-9-yl]aniline;9-(9H-fluoren-3-yl)-10-phenylanthracene
CID 160921097
N-phenyl-3-(4-phenylphenyl)-N-[4-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]aniline
CID 118103101
3-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 161050252
4-(4-carbazol-9-ylphenyl)-N-[4-[3-[3-[4-[4-(4-carbazol-9-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]anilino]phenyl]phenyl]phenyl]phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 88848896
3,6-bis(4-carbazol-9-ylphenyl)-9-(4-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(4-phenylphenyl)carbazol-3-yl]aniline
CID 158023150
N-[4-(9H-fluoren-2-yl)phenyl]-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline
CID 143813917
9,9-dimethyl-N-(4-phenylphenyl)-N-[4-[5-(4-phenylphenyl)-7H-indeno[2,1-b]carbazol-2-yl]phenyl]fluoren-3-amine
CID 154935118
1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]-3-N-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 177275836

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine?
The IUPAC name of N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine (CID 145232650) is N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine.
What is the SMILES notation for N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine?
The canonical SMILES for N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc(N(c7ccccc7)c7ccc8c(c7)-c7ccccc7C8)cc6)c5)ccc43)cc2)cc1.
What is the InChIKey of N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine?
The InChIKey is HCGPZEKIWQMJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H38N2/c1-3-12-38(13-4-1)39-22-30-48(31-23-39)57-54-21-10-9-20-51(54)53-36-43(27-33-55(53)57)42-16-11-15-41(34-42)40-24-28-47(29-25-40)56(46-17-5-2-6-18-46)49-32-26-45-35-44-14-7-8-19-50(44)52(45)37-49/h1-34,36-37H,35H2.
What are the key properties of N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine?
N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine has a molecular weight of 726.92 g/mol, XLogP of 14.83, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-9H-fluoren-3-amine is sourced from PubChem (CID 145232650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).