9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine

C65H42N4 — CID 139404287

IUPAC9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine
SMILESc1ccc(-c2nc(N(c3ccc4c(c3)c3ccccc3n4-c3ccc4ccccc4c3)c3ccccc3C3(c4ccccc4)c4ccccc4-c4c3ccc3ccccc43)nc3ccccc23)cc1
InChIInChI=1S/C65H42N4/c1-3-21-45(22-4-1)63-53-29-12-16-32-58(53)66-64(67-63)69(49-38-40-60-54(42-49)51-27-13-17-33-59(51)68(60)48-37-35-43-19-7-8-23-46(43)41-48)61-34-18-15-31-56(61)65(47-24-5-2-6-25-47)55-30-14-11-28-52(55)62-50-26-10-9-20-44(50)36-39-57(62)65/h1-42H
InChIKeyAPDRUJGTAKDRDP-UHFFFAOYSA-N
MW879.08 g/mol
LogP16.53
Rot. Bonds7

About 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine

9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine (PubChem CID 139404287) has the molecular formula C65H42N4 and a molecular weight of 879.08 g/mol. Its IUPAC name is 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine.

Molecular Properties

Compound Name9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine
PubChem CID139404287
Molecular FormulaC65H42N4
Molecular Weight879.08 g/mol
Exact Mass878.34
IUPAC Name9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine
SMILESc1ccc(-c2nc(N(c3ccc4c(c3)c3ccccc3n4-c3ccc4ccccc4c3)c3ccccc3C3(c4ccccc4)c4ccccc4-c4c3ccc3ccccc43)nc3ccccc23)cc1
InChIInChI=1S/C65H42N4/c1-3-21-45(22-4-1)63-53-29-12-16-32-58(53)66-64(67-63)69(49-38-40-60-54(42-49)51-27-13-17-33-59(51)68(60)48-37-35-43-19-7-8-23-46(43)41-48)61-34-18-15-31-56(61)65(47-24-5-2-6-25-47)55-30-14-11-28-52(55)62-50-26-10-9-20-44(50)36-39-57(62)65/h1-42H
InChIKeyAPDRUJGTAKDRDP-UHFFFAOYSA-N
XLogP16.53
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500879.08
LogP ≤ 516.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-naphthalen-2-yl-N-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine
CID 139384315
N-(6-dibenzofuran-2-yldibenzothiophen-2-yl)-4,6-diphenyl-N-[2-(9-phenylfluoren-9-yl)phenyl]-1,3,5-triazin-2-amine;N-dibenzofuran-2-yl-2,4-diphenyl-N-[2-(9-phenylfluoren-9-yl)phenyl]pyrimidin-5-amine;9,9-dimethyl-N-[2-(9-phenylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-[2-(9-phenylfluoren-9-yl)phenyl]-N-[4-(3-phenylquinoxalin-2-yl)phenyl]fluoren-3-amine;N-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylfluoren-9-yl]phenyl]-N-phenanthren-3-yldibenzofuran-1-amine;methane;9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine
CID 158940807
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)-9,9'-spirobi[fluorene]-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-4-yl)-7,7-diphenyl-N-(4-phenylphenyl)benzo[g]fluoren-9-amine
CID 161188931
N-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 71175459
N-(7,7-diphenylbenzo[c]fluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 146364307
N-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-2-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine
CID 166647123
N-naphthalen-1-yl-9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-amine
CID 129264419
N-[4-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 135299725
9-naphthalen-2-yl-N-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-amine
CID 59782759
N-(9,9-diphenylfluoren-4-yl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-3-amine
CID 168790489
7-carbazol-9-yl-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 135193230
N-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[3-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)-9,9-diphenylfluoren-2-amine;N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 161161453

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine?
The IUPAC name of 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine (CID 139404287) is 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine.
What is the SMILES notation for 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine?
The canonical SMILES for 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine is c1ccc(-c2nc(N(c3ccc4c(c3)c3ccccc3n4-c3ccc4ccccc4c3)c3ccccc3C3(c4ccccc4)c4ccccc4-c4c3ccc3ccccc43)nc3ccccc23)cc1.
What is the InChIKey of 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine?
The InChIKey is APDRUJGTAKDRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H42N4/c1-3-21-45(22-4-1)63-53-29-12-16-32-58(53)66-64(67-63)69(49-38-40-60-54(42-49)51-27-13-17-33-59(51)68(60)48-37-35-43-19-7-8-23-46(43)41-48)61-34-18-15-31-56(61)65(47-24-5-2-6-25-47)55-30-14-11-28-52(55)62-50-26-10-9-20-44(50)36-39-57(62)65/h1-42H.
What are the key properties of 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine?
9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine has a molecular weight of 879.08 g/mol, XLogP of 16.53, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-N-[2-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-N-(4-phenylquinazolin-2-yl)carbazol-3-amine is sourced from PubChem (CID 139404287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).