N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine

C61H42N2 — CID 165155547

IUPACN-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cc(-c4ccccc4)cc4c5ccccc5n(-c5ccccc5)c34)cc2)cc1
InChIInChI=1S/C61H42N2/c1-6-20-43(21-7-1)45-34-36-50(37-35-45)62(51-38-39-53-52-30-16-18-32-56(52)61(57(53)42-51,47-24-10-3-11-25-47)48-26-12-4-13-27-48)59-41-46(44-22-8-2-9-23-44)40-55-54-31-17-19-33-58(54)63(60(55)59)49-28-14-5-15-29-49/h1-42H
InChIKeyCQGLFDQGFAGVKK-UHFFFAOYSA-N
MW803.02 g/mol
LogP15.95
Rot. Bonds8

About N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine

N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine (PubChem CID 165155547) has the molecular formula C61H42N2 and a molecular weight of 803.02 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine
PubChem CID165155547
Molecular FormulaC61H42N2
Molecular Weight803.02 g/mol
Exact Mass802.33
IUPAC NameN-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cc(-c4ccccc4)cc4c5ccccc5n(-c5ccccc5)c34)cc2)cc1
InChIInChI=1S/C61H42N2/c1-6-20-43(21-7-1)45-34-36-50(37-35-45)62(51-38-39-53-52-30-16-18-32-56(52)61(57(53)42-51,47-24-10-3-11-25-47)48-26-12-4-13-27-48)59-41-46(44-22-8-2-9-23-44)40-55-54-31-17-19-33-58(54)63(60(55)59)49-28-14-5-15-29-49/h1-42H
InChIKeyCQGLFDQGFAGVKK-UHFFFAOYSA-N
XLogP15.95
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500803.02
LogP ≤ 515.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,3,9-triphenyl-N-(9,9'-spirobi[fluorene]-2-yl)carbazol-1-amine
CID 165155466
N-[4-[3,5-bis(9-phenylcarbazol-1-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 118289063
9,9-diphenyl-N-[4-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 89426449
N-(4-carbazol-9-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N,9,9-triphenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]fluoren-2-amine;N,9,9-triphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 162125259
9,9-diphenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 90124595
N,9,9-triphenyl-N-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 118640942
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381439
N-(9,9-diphenylfluoren-2-yl)-9-phenyl-N-(2-phenylphenyl)carbazol-1-amine
CID 155004211
N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 90393429
N,9-diphenyl-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]carbazol-2-amine
CID 170375341
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 160652754
N-[2-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 118087630

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine?
The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine (CID 165155547) is N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cc(-c4ccccc4)cc4c5ccccc5n(-c5ccccc5)c34)cc2)cc1.
What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine?
The InChIKey is CQGLFDQGFAGVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42N2/c1-6-20-43(21-7-1)45-34-36-50(37-35-45)62(51-38-39-53-52-30-16-18-32-56(52)61(57(53)42-51,47-24-10-3-11-25-47)48-26-12-4-13-27-48)59-41-46(44-22-8-2-9-23-44)40-55-54-31-17-19-33-58(54)63(60(55)59)49-28-14-5-15-29-49/h1-42H.
What are the key properties of N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine?
N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine has a molecular weight of 803.02 g/mol, XLogP of 15.95, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine is sourced from PubChem (CID 165155547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).