9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane

C76H58N2 — CID 145110290

IUPAC9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane
SMILESCCC.c1ccc(-c2ccc(N(c3ccc(-n4c5cc(-c6ccccc6)ccc5c5cc(-c6ccccc6)cc(-c6ccccc6)c54)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C73H50N2.C3H8/c1-7-21-51(22-8-1)54-35-38-60(39-36-54)74(63-44-46-65-64-33-19-20-34-69(64)73(70(65)50-63,58-29-15-5-16-30-58)59-31-17-6-18-32-59)61-40-42-62(43-41-61)75-71-49-56(52-23-9-2-10-24-52)37-45-66(71)68-48-57(53-25-11-3-12-26-53)47-67(72(68)75)55-27-13-4-14-28-55;1-3-2/h1-50H;3H2,1-2H3
InChIKeyOIERZMPMLLSXHP-UHFFFAOYSA-N
MW999.31 g/mol
LogP20.70
Rot. Bonds10

About 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane

9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane (PubChem CID 145110290) has the molecular formula C76H58N2 and a molecular weight of 999.31 g/mol. Its IUPAC name is 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane.

Molecular Properties

Compound Name9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane
PubChem CID145110290
Molecular FormulaC76H58N2
Molecular Weight999.31 g/mol
Exact Mass998.46
IUPAC Name9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane
SMILESCCC.c1ccc(-c2ccc(N(c3ccc(-n4c5cc(-c6ccccc6)ccc5c5cc(-c6ccccc6)cc(-c6ccccc6)c54)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C73H50N2.C3H8/c1-7-21-51(22-8-1)54-35-38-60(39-36-54)74(63-44-46-65-64-33-19-20-34-69(64)73(70(65)50-63,58-29-15-5-16-30-58)59-31-17-6-18-32-59)61-40-42-62(43-41-61)75-71-49-56(52-23-9-2-10-24-52)37-45-66(71)68-48-57(53-25-11-3-12-26-53)47-67(72(68)75)55-27-13-4-14-28-55;1-3-2/h1-50H;3H2,1-2H3
InChIKeyOIERZMPMLLSXHP-UHFFFAOYSA-N
XLogP20.70
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500999.31
LogP ≤ 520.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9,9-diphenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 90124595
N,9,9-triphenyl-N-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]fluoren-2-amine
CID 118505876
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(11-phenylbenzo[a]carbazol-9-yl)phenyl]fluoren-2-amine
CID 168782174
9,9-diphenyl-N-(4-phenylphenyl)-N-[3-phenyl-5-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]fluoren-2-amine
CID 118265823
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-dimethyl-N-(4-phenylphenyl)-N-[4-[4-(1,3,6-triphenylcarbazol-9-yl)phenyl]phenyl]fluoren-2-amine
CID 121445598
9,9-diphenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 167214675
N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine
CID 165155547
9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 118505688
9,9-diphenyl-N-[4-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 89426449
9,9-diphenyl-N-(6-phenylnaphthalen-2-yl)-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 159629958
N-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N,4-diphenylaniline
CID 118682510

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane?
The IUPAC name of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane (CID 145110290) is 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane.
What is the SMILES notation for 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane?
The canonical SMILES for 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane is CCC.c1ccc(-c2ccc(N(c3ccc(-n4c5cc(-c6ccccc6)ccc5c5cc(-c6ccccc6)cc(-c6ccccc6)c54)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.
What is the InChIKey of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane?
The InChIKey is OIERZMPMLLSXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H50N2.C3H8/c1-7-21-51(22-8-1)54-35-38-60(39-36-54)74(63-44-46-65-64-33-19-20-34-69(64)73(70(65)50-63,58-29-15-5-16-30-58)59-31-17-6-18-32-59)61-40-42-62(43-41-61)75-71-49-56(52-23-9-2-10-24-52)37-45-66(71)68-48-57(53-25-11-3-12-26-53)47-67(72(68)75)55-27-13-4-14-28-55;1-3-2/h1-50H;3H2,1-2H3.
What are the key properties of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane?
9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane has a molecular weight of 999.31 g/mol, XLogP of 20.70, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(1,3,7-triphenylcarbazol-9-yl)phenyl]fluoren-2-amine;propane is sourced from PubChem (CID 145110290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).