N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine

C118H88N2O2 — CID 170143287

IUPACN-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine
SMILESCC1(C)C2=C(CCC=C2)c2c(-c3ccccc3N(c3ccc(-c4cccc5oc6c7cc(-c8ccc9c(c8)-c8cc(-c%10ccccc%10N(c%10ccccc%10-c%10ccc%11c(c%10)oc%10ccccc%10%11)c%10ccccc%10-c%10cccc%11c%10-c%10ccccc%10C%11(C)C)ccc8C9(C)C)ccc7ccc6c45)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21
InChIInChI=1S/C118H88N2O2/c1-115(2)99-64-56-74(67-94(99)95-68-75(57-65-100(95)115)79-28-12-20-44-104(79)120(105-45-21-13-29-80(105)76-55-61-87-86-33-16-24-48-108(86)121-110(87)69-76)107-47-23-15-32-85(107)89-38-26-43-102-112(89)91-35-11-19-41-98(91)117(102,5)6)73-51-50-72-54-62-92-113-81(36-27-49-109(113)122-114(92)93(72)66-73)71-52-58-77(59-53-71)119(78-60-63-83-82-30-9-17-39-96(82)118(7,8)103(83)70-78)106-46-22-14-31-84(106)88-37-25-42-101-111(88)90-34-10-18-40-97(90)116(101,3)4/h9,11-33,35-70H,10,34H2,1-8H3
InChIKeyKBYDJFGUTXCGCK-UHFFFAOYSA-N
MW1566.01 g/mol
LogP32.89
Rot. Bonds12

About N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine

N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine (PubChem CID 170143287) has the molecular formula C118H88N2O2 and a molecular weight of 1566.01 g/mol. Its IUPAC name is N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine
PubChem CID170143287
Molecular FormulaC118H88N2O2
Molecular Weight1566.01 g/mol
Exact Mass1564.68
IUPAC NameN-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine
SMILESCC1(C)C2=C(CCC=C2)c2c(-c3ccccc3N(c3ccc(-c4cccc5oc6c7cc(-c8ccc9c(c8)-c8cc(-c%10ccccc%10N(c%10ccccc%10-c%10ccc%11c(c%10)oc%10ccccc%10%11)c%10ccccc%10-c%10cccc%11c%10-c%10ccccc%10C%11(C)C)ccc8C9(C)C)ccc7ccc6c45)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21
InChIInChI=1S/C118H88N2O2/c1-115(2)99-64-56-74(67-94(99)95-68-75(57-65-100(95)115)79-28-12-20-44-104(79)120(105-45-21-13-29-80(105)76-55-61-87-86-33-16-24-48-108(86)121-110(87)69-76)107-47-23-15-32-85(107)89-38-26-43-102-112(89)91-35-11-19-41-98(91)117(102,5)6)73-51-50-72-54-62-92-113-81(36-27-49-109(113)122-114(92)93(72)66-73)71-52-58-77(59-53-71)119(78-60-63-83-82-30-9-17-39-96(82)118(7,8)103(83)70-78)106-46-22-14-31-84(106)88-37-25-42-101-111(88)90-34-10-18-40-97(90)116(101,3)4/h9,11-33,35-70H,10,34H2,1-8H3
InChIKeyKBYDJFGUTXCGCK-UHFFFAOYSA-N
XLogP32.89
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms122
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001566.01
LogP ≤ 532.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine with MolForge

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Related Compounds

2-(9,9-dimethylfluoren-2-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-(3-naphtho[1,2-b][1]benzofuran-7-ylphenyl)aniline
CID 170143125
N-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-N-phenyl-10,11-dihydrofluoreno[4,3-b][1]benzofuran-1-amine
CID 138489071
N-(4-dibenzofuran-3-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 170138885
2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170139876
N-(4-dibenzofuran-3-ylphenyl)-9,9-dimethyl-N-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine
CID 138462029
N-(4-dibenzofuran-3-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)-6,6,12,12-tetramethyl-9-phenylindeno[1,2-b]fluoren-2-amine
CID 138455866
N-(4-dibenzofuran-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-4-yl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 177121792
N-(3-dibenzofuran-2-ylphenyl)-2-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]aniline
CID 170143107
N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)fluoren-2-amine
CID 166938984
N-(11-dibenzofuran-3-yl-14,14-dimethyl-9-oxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-17-yl)-15,15,25,25-tetramethyl-N-(2-phenylphenyl)-10-oxaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19(24),20,22,26-dodecaen-22-amine
CID 146436608
N-(3-dibenzofuran-3-ylphenyl)-N-[2-(9,9-dimethylfluoren-3-yl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 177121520
N-(3-dibenzofuran-3-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9-methyl-9-phenylfluoren-2-amine
CID 170139028

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine (CID 170143287) is N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine is CC1(C)C2=C(CCC=C2)c2c(-c3ccccc3N(c3ccc(-c4cccc5oc6c7cc(-c8ccc9c(c8)-c8cc(-c%10ccccc%10N(c%10ccccc%10-c%10ccc%11c(c%10)oc%10ccccc%10%11)c%10ccccc%10-c%10cccc%11c%10-c%10ccccc%10C%11(C)C)ccc8C9(C)C)ccc7ccc6c45)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.
What is the InChIKey of N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine?
The InChIKey is KBYDJFGUTXCGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C118H88N2O2/c1-115(2)99-64-56-74(67-94(99)95-68-75(57-65-100(95)115)79-28-12-20-44-104(79)120(105-45-21-13-29-80(105)76-55-61-87-86-33-16-24-48-108(86)121-110(87)69-76)107-47-23-15-32-85(107)89-38-26-43-102-112(89)91-35-11-19-41-98(91)117(102,5)6)73-51-50-72-54-62-92-113-81(36-27-49-109(113)122-114(92)93(72)66-73)71-52-58-77(59-53-71)119(78-60-63-83-82-30-9-17-39-96(82)118(7,8)103(83)70-78)106-46-22-14-31-84(106)88-37-25-42-101-111(88)90-34-10-18-40-97(90)116(101,3)4/h9,11-33,35-70H,10,34H2,1-8H3.
What are the key properties of N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine?
N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine has a molecular weight of 1566.01 g/mol, XLogP of 32.89, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-[6-[2-(2-dibenzofuran-3-yl-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]anilino)phenyl]-9,9-dimethylfluoren-3-yl]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-N-[2-(9,9-dimethyl-5,6-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 170143287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).