N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine

C61H41NO — CID 163646447

IUPACN-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine
SMILESc1ccc(-c2cccc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)oc4cc(C6(c7cccc(-c8ccccc8)c7)c7ccccc7-c7ccccc76)ccc45)c3)c2)cc1
InChIInChI=1S/C61H41NO/c1-4-17-42(18-5-1)44-21-14-22-45(37-44)47-24-16-28-51(39-47)62(50-26-8-3-9-27-50)52-34-36-56-55-35-33-49(40-59(55)63-60(56)41-52)61(48-25-15-23-46(38-48)43-19-6-2-7-20-43)57-31-12-10-29-53(57)54-30-11-13-32-58(54)61/h1-41H
InChIKeyCLNDTPBHXCRZKC-UHFFFAOYSA-N
MW804.01 g/mol
LogP16.42
Rot. Bonds8

About N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine

N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine (PubChem CID 163646447) has the molecular formula C61H41NO and a molecular weight of 804.01 g/mol. Its IUPAC name is N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine.

Molecular Properties

Compound NameN-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine
PubChem CID163646447
Molecular FormulaC61H41NO
Molecular Weight804.01 g/mol
Exact Mass803.32
IUPAC NameN-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine
SMILESc1ccc(-c2cccc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)oc4cc(C6(c7cccc(-c8ccccc8)c7)c7ccccc7-c7ccccc76)ccc45)c3)c2)cc1
InChIInChI=1S/C61H41NO/c1-4-17-42(18-5-1)44-21-14-22-45(37-44)47-24-16-28-51(39-47)62(50-26-8-3-9-27-50)52-34-36-56-55-35-33-49(40-59(55)63-60(56)41-52)61(48-25-15-23-46(38-48)43-19-6-2-7-20-43)57-31-12-10-29-53(57)54-30-11-13-32-58(54)61/h1-41H
InChIKeyCLNDTPBHXCRZKC-UHFFFAOYSA-N
XLogP16.42
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500804.01
LogP ≤ 516.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine
CID 163514817
N,7-diphenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-3-amine;N,7-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-3-amine;N,7-diphenyl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-3-amine;N,7-diphenyl-N-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-3-amine
CID 163960848
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine;N-phenyl-N-(4-phenylphenyl)-3-[7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-yl]aniline
CID 163450509
N,N-diphenyl-4-[3-[7-(9-phenylfluoren-9-yl)dibenzofuran-2-yl]phenyl]aniline;3-phenyl-N-[3-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 163830866
N-(4-dibenzofuran-3-ylphenyl)-3-[4-(9,9-diphenylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 168840154
8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-3-amine;N-phenyl-8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)dibenzofuran-3-amine;N-phenyl-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 163747382
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-3-(4-phenylphenyl)aniline
CID 121381640
7-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 163827200
5-phenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-9-amine
CID 176808325
7-(11-phenylbenzo[a]fluoren-11-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-1-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-7-[9-(3-phenylphenyl)fluoren-9-yl]dibenzofuran-3-amine
CID 163721882
N-phenyl-3-[9-(9-phenylfluoren-9-yl)dibenzofuran-3-yl]-N-(4-phenylphenyl)aniline
CID 163630205
N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 163940771

Frequently Asked Questions

What is the IUPAC name of N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine?
The IUPAC name of N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine (CID 163646447) is N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine.
What is the SMILES notation for N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine?
The canonical SMILES for N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine is c1ccc(-c2cccc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)oc4cc(C6(c7cccc(-c8ccccc8)c7)c7ccccc7-c7ccccc76)ccc45)c3)c2)cc1.
What is the InChIKey of N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine?
The InChIKey is CLNDTPBHXCRZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H41NO/c1-4-17-42(18-5-1)44-21-14-22-45(37-44)47-24-16-28-51(39-47)62(50-26-8-3-9-27-50)52-34-36-56-55-35-33-49(40-59(55)63-60(56)41-52)61(48-25-15-23-46(38-48)43-19-6-2-7-20-43)57-31-12-10-29-53(57)54-30-11-13-32-58(54)61/h1-41H.
What are the key properties of N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine?
N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine has a molecular weight of 804.01 g/mol, XLogP of 16.42, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-7-[9-(3-phenylphenyl)fluoren-9-yl]-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-amine is sourced from PubChem (CID 163646447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).