N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine

C62H43N3 — CID 158815387

IUPACN-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine
SMILESc1ccc(N2c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4ccc5ccccc5c4)cc3Cc3c2n(-c2ccccc2)c2ccccc32)cc1
InChIInChI=1S/C62H43N3/c1-5-21-46(22-6-1)62(47-23-7-2-8-24-47)57-31-17-15-29-53(57)54-37-35-52(42-58(54)62)63(50-34-33-43-19-13-14-20-44(43)39-50)51-36-38-59-45(40-51)41-56-55-30-16-18-32-60(55)65(49-27-11-4-12-28-49)61(56)64(59)48-25-9-3-10-26-48/h1-40,42H,41H2
InChIKeyRMHORVOTENEKHL-UHFFFAOYSA-N
MW830.05 g/mol
LogP15.99
Rot. Bonds7

About N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine

N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine (PubChem CID 158815387) has the molecular formula C62H43N3 and a molecular weight of 830.05 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine
PubChem CID158815387
Molecular FormulaC62H43N3
Molecular Weight830.05 g/mol
Exact Mass829.35
IUPAC NameN-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine
SMILESc1ccc(N2c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4ccc5ccccc5c4)cc3Cc3c2n(-c2ccccc2)c2ccccc32)cc1
InChIInChI=1S/C62H43N3/c1-5-21-46(22-6-1)62(47-23-7-2-8-24-47)57-31-17-15-29-53(57)54-37-35-52(42-58(54)62)63(50-34-33-43-19-13-14-20-44(43)39-50)51-36-38-59-45(40-51)41-56-55-30-16-18-32-60(55)65(49-27-11-4-12-28-49)61(56)64(59)48-25-9-3-10-26-48/h1-40,42H,41H2
InChIKeyRMHORVOTENEKHL-UHFFFAOYSA-N
XLogP15.99
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500830.05
LogP ≤ 515.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-naphthalen-2-yl-9,9-diphenyl-N-[9-phenyl-9-(9-phenylcarbazol-3-yl)fluoren-2-yl]fluoren-2-amine
CID 134452960
N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-9-phenylcarbazol-1-amine
CID 177080037
N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-2,9-diphenylcarbazol-3-amine
CID 165155346
4-N-(9,9-diphenylfluoren-2-yl)-2-methyl-1-N-(3-methyl-1-phenylindol-2-yl)-4-N-naphthalen-2-yl-1-N-phenylbenzene-1,4-diamine
CID 146370054
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-2-amine
CID 166565681
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenylfluoren-2-amine
CID 166566306
17-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-phenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaen-6-amine
CID 166032529
N-(9,9-diphenylfluoren-2-yl)-4-naphthalen-2-yl-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 165155471
N-anthracen-2-yl-N-(9,9-diphenylfluoren-2-yl)-5-methyl-9-phenyl-5,6-dihydrocarbazol-3-amine
CID 88891816
N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
CID 163530919
N-(9,9-diphenylfluoren-2-yl)-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-naphthalen-2-ylanilino)phenyl]naphthalen-1-yl]carbazol-3-amine
CID 163462319
N-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 71175459

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine?
The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine (CID 158815387) is N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine is c1ccc(N2c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4ccc5ccccc5c4)cc3Cc3c2n(-c2ccccc2)c2ccccc32)cc1.
What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine?
The InChIKey is RMHORVOTENEKHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H43N3/c1-5-21-46(22-6-1)62(47-23-7-2-8-24-47)57-31-17-15-29-53(57)54-37-35-52(42-58(54)62)63(50-34-33-43-19-13-14-20-44(43)39-50)51-36-38-59-45(40-51)41-56-55-30-16-18-32-60(55)65(49-27-11-4-12-28-49)61(56)64(59)48-25-9-3-10-26-48/h1-40,42H,41H2.
What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine?
N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine has a molecular weight of 830.05 g/mol, XLogP of 15.99, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-5,6-diphenyl-11H-indolo[2,3-b]quinolin-2-amine is sourced from PubChem (CID 158815387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).