N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine

C69H43NO2 — CID 177121766

IUPACN,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6c5oc5c7ccccc7ccc65)cc4)c4ccc(-c5cccc6c5oc5c7ccccc7ccc65)cc4)cccc32)cc1
InChIInChI=1S/C69H43NO2/c1-3-18-48(19-4-1)69(49-20-5-2-6-21-49)61-29-12-11-24-60(61)64-62(69)30-15-31-63(64)70(50-38-32-46(33-39-50)54-25-13-27-56-58-42-36-44-16-7-9-22-52(44)67(58)71-65(54)56)51-40-34-47(35-41-51)55-26-14-28-57-59-43-37-45-17-8-10-23-53(45)68(59)72-66(55)57/h1-43H
InChIKeyLQCYQILWYQLNPA-UHFFFAOYSA-N
MW918.11 g/mol
LogP18.96
Rot. Bonds7

About N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine

N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine (PubChem CID 177121766) has the molecular formula C69H43NO2 and a molecular weight of 918.11 g/mol. Its IUPAC name is N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine.

Molecular Properties

Compound NameN,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine
PubChem CID177121766
Molecular FormulaC69H43NO2
Molecular Weight918.11 g/mol
Exact Mass917.33
IUPAC NameN,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6c5oc5c7ccccc7ccc65)cc4)c4ccc(-c5cccc6c5oc5c7ccccc7ccc65)cc4)cccc32)cc1
InChIInChI=1S/C69H43NO2/c1-3-18-48(19-4-1)69(49-20-5-2-6-21-49)61-29-12-11-24-60(61)64-62(69)30-15-31-63(64)70(50-38-32-46(33-39-50)54-25-13-27-56-58-42-36-44-16-7-9-22-52(44)67(58)71-65(54)56)51-40-34-47(35-41-51)55-26-14-28-57-59-43-37-45-17-8-10-23-53(45)68(59)72-66(55)57/h1-43H
InChIKeyLQCYQILWYQLNPA-UHFFFAOYSA-N
XLogP18.96
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500918.11
LogP ≤ 518.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(9,9-diphenylfluoren-4-yl)-9,9-dimethyl-N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)fluoren-4-amine
CID 177121861
N-(9,9-diphenylfluoren-4-yl)-N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
CID 177121793
N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-N-(4-naphtho[1,2-b][1]benzothiol-10-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 177122214
N-(9,9-diphenylfluoren-4-yl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 177121797
N-[4-(4-tert-butylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)naphtho[1,2-b][1]benzofuran-10-amine
CID 177122140
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 146251209
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
CID 139355192
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-4-amine
CID 169020437
N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-N,9,9-triphenylfluoren-2-amine
CID 177121964
9,9-dimethyl-N-naphthalen-1-yl-N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)fluoren-4-amine
CID 177122090
N-(9,9-diphenylfluoren-4-yl)-N-(4-naphthalen-1-ylphenyl)-6-phenyldibenzofuran-1-amine
CID 172544730
N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)-6-phenyldibenzofuran-3-amine
CID 169302165

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine?
The IUPAC name of N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine (CID 177121766) is N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine.
What is the SMILES notation for N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine?
The canonical SMILES for N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6c5oc5c7ccccc7ccc65)cc4)c4ccc(-c5cccc6c5oc5c7ccccc7ccc65)cc4)cccc32)cc1.
What is the InChIKey of N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine?
The InChIKey is LQCYQILWYQLNPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H43NO2/c1-3-18-48(19-4-1)69(49-20-5-2-6-21-49)61-29-12-11-24-60(61)64-62(69)30-15-31-63(64)70(50-38-32-46(33-39-50)54-25-13-27-56-58-42-36-44-16-7-9-22-52(44)67(58)71-65(54)56)51-40-34-47(35-41-51)55-26-14-28-57-59-43-37-45-17-8-10-23-53(45)68(59)72-66(55)57/h1-43H.
What are the key properties of N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine?
N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine has a molecular weight of 918.11 g/mol, XLogP of 18.96, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9,9-diphenylfluoren-4-amine is sourced from PubChem (CID 177121766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).