9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine

C64H46N2 — CID 145370465

IUPAC9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4cc5c(c6c4c4ccccc4n6-c4ccccc4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc21
InChIInChI=1S/C64H46N2/c1-63(2)55-32-18-15-29-50(55)51-40-39-49(41-57(51)63)65(46-25-11-5-12-26-46)48-37-35-43(36-38-48)54-42-58-61(62-60(54)53-31-17-20-34-59(53)66(62)47-27-13-6-14-28-47)52-30-16-19-33-56(52)64(58,44-21-7-3-8-22-44)45-23-9-4-10-24-45/h3-42H,1-2H3
InChIKeyIWIWCTGBZGYREZ-UHFFFAOYSA-N
MW843.09 g/mol
LogP16.59
Rot. Bonds7

About 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine

9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine (PubChem CID 145370465) has the molecular formula C64H46N2 and a molecular weight of 843.09 g/mol. Its IUPAC name is 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine
PubChem CID145370465
Molecular FormulaC64H46N2
Molecular Weight843.09 g/mol
Exact Mass842.37
IUPAC Name9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4cc5c(c6c4c4ccccc4n6-c4ccccc4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc21
InChIInChI=1S/C64H46N2/c1-63(2)55-32-18-15-29-50(55)51-40-39-49(41-57(51)63)65(46-25-11-5-12-26-46)48-37-35-43(36-38-48)54-42-58-61(62-60(54)53-31-17-20-34-59(53)66(62)47-27-13-6-14-28-47)52-30-16-19-33-56(52)64(58,44-21-7-3-8-22-44)45-23-9-4-10-24-45/h3-42H,1-2H3
InChIKeyIWIWCTGBZGYREZ-UHFFFAOYSA-N
XLogP16.59
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500843.09
LogP ≤ 516.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-N,9-diphenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9-phenyl-N-(9-phenylcarbazol-3-yl)carbazol-3-amine;N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenyl-N-(9-phenylcarbazol-3-yl)carbazol-3-amine
CID 157289392
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-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-dimethyl-N-[4-(14-phenyl-14-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaenyl)phenyl]fluoren-2-amine
CID 121391609
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-amine
CID 129264404
9,9-dimethyl-N-phenyl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;N,9,9-triphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 158043752
N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylcarbazol-3-amine
CID 126605201
9,9-dimethyl-N-phenyl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;methane;N,9,9-triphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 162012956
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-1-[2-(9-phenylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine
CID 139384267
9,9-dimethyl-N-phenyl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;methane
CID 159335093
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[9-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-yl]phenyl]fluoren-2-amine
CID 167334138
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-phenylphenyl)fluoren-2-amine;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-dimethyl-N-phenyl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 162087677
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-2-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-4-amine
CID 166647118

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine (CID 145370465) is 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4cc5c(c6c4c4ccccc4n6-c4ccccc4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc21.
What is the InChIKey of 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine?
The InChIKey is IWIWCTGBZGYREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H46N2/c1-63(2)55-32-18-15-29-50(55)51-40-39-49(41-57(51)63)65(46-25-11-5-12-26-46)48-37-35-43(36-38-48)54-42-58-61(62-60(54)53-31-17-20-34-59(53)66(62)47-27-13-6-14-28-47)52-30-16-19-33-56(52)64(58,44-21-7-3-8-22-44)45-23-9-4-10-24-45/h3-42H,1-2H3.
What are the key properties of 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine?
9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine has a molecular weight of 843.09 g/mol, XLogP of 16.59, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-phenyl-N-[4-(7,7,12-triphenylindeno[1,2-a]carbazol-5-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 145370465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).