N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine

C159H103N3O5S — CID 166939747

IUPACN-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5oc6c(-c7cccc8c7ccc7c8oc8cccc(-c9ccccc9N(c9ccc(-c%10cccc%11c%10oc%10ccc(-c%12cccc%13c%12ccc%12c%13oc%13cccc(-c%14ccccc%14N(c%14ccc%15c(c%14)C(C)(C)c%14ccccc%14-%15)c%14ccc%15c(c%14)sc%14ccccc%14%15)c%13%12)cc%10%11)cc9)c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)c87)cccc6c45)cc3)c3ccccc3-c3cccc4oc5c6ccccc6ccc5c34)cc21
InChIInChI=1S/C159H103N3O5S/c1-157(2)132-52-16-9-33-109(132)112-78-73-98(88-135(112)157)160(138-55-19-12-36-115(138)120-44-28-59-143-149(120)128-77-67-92-31-7-8-32-104(92)153(128)164-143)96-69-63-93(64-70-96)103-41-27-58-142-148(103)127-51-26-49-123(154(127)165-142)106-43-25-48-125-108(106)83-85-130-150-121(45-29-61-145(150)167-156(125)130)116-37-13-20-56-139(116)161(99-74-79-113-110-34-10-17-53-133(110)158(3,4)136(113)89-99)97-71-65-94(66-72-97)105-42-24-50-126-131-87-95(68-86-141(131)163-152(105)126)102-40-23-47-124-107(102)82-84-129-151-122(46-30-60-144(151)166-155(124)129)117-38-14-21-57-140(117)162(101-76-81-119-118-39-15-22-62-146(118)168-147(119)91-101)100-75-80-114-111-35-11-18-54-134(111)159(5,6)137(114)90-100/h7-91H,1-6H3
InChIKeyVABVKQSBFDKUIA-UHFFFAOYSA-N
MW2167.66 g/mol
LogP46.01
Rot. Bonds16

About N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine

N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine (PubChem CID 166939747) has the molecular formula C159H103N3O5S and a molecular weight of 2167.66 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine
PubChem CID166939747
Molecular FormulaC159H103N3O5S
Molecular Weight2167.66 g/mol
Exact Mass2165.76
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5oc6c(-c7cccc8c7ccc7c8oc8cccc(-c9ccccc9N(c9ccc(-c%10cccc%11c%10oc%10ccc(-c%12cccc%13c%12ccc%12c%13oc%13cccc(-c%14ccccc%14N(c%14ccc%15c(c%14)C(C)(C)c%14ccccc%14-%15)c%14ccc%15c(c%14)sc%14ccccc%14%15)c%13%12)cc%10%11)cc9)c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)c87)cccc6c45)cc3)c3ccccc3-c3cccc4oc5c6ccccc6ccc5c34)cc21
InChIInChI=1S/C159H103N3O5S/c1-157(2)132-52-16-9-33-109(132)112-78-73-98(88-135(112)157)160(138-55-19-12-36-115(138)120-44-28-59-143-149(120)128-77-67-92-31-7-8-32-104(92)153(128)164-143)96-69-63-93(64-70-96)103-41-27-58-142-148(103)127-51-26-49-123(154(127)165-142)106-43-25-48-125-108(106)83-85-130-150-121(45-29-61-145(150)167-156(125)130)116-37-13-20-56-139(116)161(99-74-79-113-110-34-10-17-53-133(110)158(3,4)136(113)89-99)97-71-65-94(66-72-97)105-42-24-50-126-131-87-95(68-86-141(131)163-152(105)126)102-40-23-47-124-107(102)82-84-129-151-122(46-30-60-144(151)166-155(124)129)117-38-14-21-57-140(117)162(101-76-81-119-118-39-15-22-62-146(118)168-147(119)91-101)100-75-80-114-111-35-11-18-54-134(111)159(5,6)137(114)90-100/h7-91H,1-6H3
InChIKeyVABVKQSBFDKUIA-UHFFFAOYSA-N
XLogP46.01
TPSA75.42 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds16
Heavy Atoms168
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002167.66
LogP ≤ 546.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine with MolForge

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Related Compounds

N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-N-(2-naphtho[1,2-b][1]benzofuran-7-ylphenyl)dibenzothiophen-3-amine
CID 167330802
N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)fluoren-2-amine
CID 166938984
N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)fluoren-2-amine
CID 166939643
N-(4-dibenzofuran-4-ylnaphthalen-1-yl)-N-[4-[4-(N-phenylanilino)phenyl]phenyl]triphenylen-2-amine;2-N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-N,7-N-diphenyl-2-N-triphenylen-2-ylfluorene-2,7-diamine;7-N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-triphenylen-2-ylfluorene-2,7-diamine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-(N-phenylanilino)naphthalen-1-yl]phenyl]triphenylen-2-amine;2-N-(4-dibenzothiophen-2-ylnaphthalen-1-yl)-9,9-dimethyl-7-N,7-N-diphenyl-2-N-triphenylen-2-ylfluorene-2,7-diamine;2-N-(4-dibenzothiophen-2-ylnaphthalen-1-yl)-9,9-dimethyl-7-N-naphthalen-1-yl-7-N-phenyl-2-N-triphenylen-2-ylfluorene-2,7-diamine
CID 162050229
N-dibenzothiophen-3-yl-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine
CID 171737995
N-(4-naphthalen-1-ylphenyl)-N-(2-naphtho[1,2-b][1]benzofuran-8-ylphenyl)dibenzothiophen-2-amine
CID 174292259
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(3-naphtho[1,2-b][1]benzofuran-7-ylphenyl)fluoren-2-amine
CID 166939628
N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-7-naphthalen-2-yl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-naphthalen-2-yl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-7-naphthalen-2-yl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-9,9-dimethyl-7-naphthalen-2-yl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 160760563
N-(2-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-N-(4-phenanthren-2-ylphenyl)dibenzothiophen-3-amine
CID 166939205
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)dibenzothiophen-1-amine
CID 177121672
N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-(2-naphtho[1,2-b][1]benzofuran-7-ylphenyl)fluoren-1-amine
CID 167330799
4-(7-dibenzofuran-4-yl-9,9-dimethylfluoren-3-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-3-ylphenyl)aniline
CID 168839647

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine (CID 166939747) is N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5oc6c(-c7cccc8c7ccc7c8oc8cccc(-c9ccccc9N(c9ccc(-c%10cccc%11c%10oc%10ccc(-c%12cccc%13c%12ccc%12c%13oc%13cccc(-c%14ccccc%14N(c%14ccc%15c(c%14)C(C)(C)c%14ccccc%14-%15)c%14ccc%15c(c%14)sc%14ccccc%14%15)c%13%12)cc%10%11)cc9)c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)c87)cccc6c45)cc3)c3ccccc3-c3cccc4oc5c6ccccc6ccc5c34)cc21.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine?
The InChIKey is VABVKQSBFDKUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C159H103N3O5S/c1-157(2)132-52-16-9-33-109(132)112-78-73-98(88-135(112)157)160(138-55-19-12-36-115(138)120-44-28-59-143-149(120)128-77-67-92-31-7-8-32-104(92)153(128)164-143)96-69-63-93(64-70-96)103-41-27-58-142-148(103)127-51-26-49-123(154(127)165-142)106-43-25-48-125-108(106)83-85-130-150-121(45-29-61-145(150)167-156(125)130)116-37-13-20-56-139(116)161(99-74-79-113-110-34-10-17-53-133(110)158(3,4)136(113)89-99)97-71-65-94(66-72-97)105-42-24-50-126-131-87-95(68-86-141(131)163-152(105)126)102-40-23-47-124-107(102)82-84-129-151-122(46-30-60-144(151)166-155(124)129)117-38-14-21-57-140(117)162(101-76-81-119-118-39-15-22-62-146(118)168-147(119)91-101)100-75-80-114-111-35-11-18-54-134(111)159(5,6)137(114)90-100/h7-91H,1-6H3.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine?
N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine has a molecular weight of 2167.66 g/mol, XLogP of 46.01, 16 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-N-[2-[4-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-2-[4-[9-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphtho[1,2-b][1]benzofuran-7-ylanilino)phenyl]dibenzofuran-4-yl]naphtho[1,2-b][1]benzofuran-7-yl]anilino]phenyl]dibenzofuran-2-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]dibenzothiophen-3-amine is sourced from PubChem (CID 166939747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).