N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline

C140H110N4 — CID 59566466

IUPACN-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
SMILESCCC(C)c1ccc(N(c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)c2ccc(-c3cccc(-c4ccc(N(c5ccc(-c6ccc(N(c7ccc(-c8ccc(-c9ccccc9)cc8)cc7)c7ccc(-c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8)cc7)cc6)cc5)c5ccc(C(C)CC)cc5)cc4)c3)cc2)cc1
InChIInChI=1S/C140H110N4/c1-5-99(3)101-50-74-129(75-51-101)141(131-86-62-121(63-87-131)123-66-90-137(91-67-123)143(133-78-54-117(55-79-133)113-40-32-108(33-41-113)104-22-13-8-14-23-104)134-80-56-118(57-81-134)114-42-34-109(35-43-114)105-24-15-9-16-25-105)139-94-70-125(71-95-139)127-28-19-29-128(98-127)126-72-96-140(97-73-126)142(130-76-52-102(53-77-130)100(4)6-2)132-88-64-122(65-89-132)124-68-92-138(93-69-124)144(135-82-58-119(59-83-135)115-44-36-110(37-45-115)106-26-17-10-18-27-106)136-84-60-120(61-85-136)116-48-46-112(47-49-116)111-38-30-107(31-39-111)103-20-11-7-12-21-103/h7-100H,5-6H2,1-4H3
InChIKeyGHVWZXCZJPSYAN-UHFFFAOYSA-N
MW1848.45 g/mol
LogP40.26
Rot. Bonds29

About N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline

N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline (PubChem CID 59566466) has the molecular formula C140H110N4 and a molecular weight of 1848.45 g/mol. Its IUPAC name is N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound NameN-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
PubChem CID59566466
Molecular FormulaC140H110N4
Molecular Weight1848.45 g/mol
Exact Mass1846.87
IUPAC NameN-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
SMILESCCC(C)c1ccc(N(c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)c2ccc(-c3cccc(-c4ccc(N(c5ccc(-c6ccc(N(c7ccc(-c8ccc(-c9ccccc9)cc8)cc7)c7ccc(-c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8)cc7)cc6)cc5)c5ccc(C(C)CC)cc5)cc4)c3)cc2)cc1
InChIInChI=1S/C140H110N4/c1-5-99(3)101-50-74-129(75-51-101)141(131-86-62-121(63-87-131)123-66-90-137(91-67-123)143(133-78-54-117(55-79-133)113-40-32-108(33-41-113)104-22-13-8-14-23-104)134-80-56-118(57-81-134)114-42-34-109(35-43-114)105-24-15-9-16-25-105)139-94-70-125(71-95-139)127-28-19-29-128(98-127)126-72-96-140(97-73-126)142(130-76-52-102(53-77-130)100(4)6-2)132-88-64-122(65-89-132)124-68-92-138(93-69-124)144(135-82-58-119(59-83-135)115-44-36-110(37-45-115)106-26-17-10-18-27-106)136-84-60-120(61-85-136)116-48-46-112(47-49-116)111-38-30-107(31-39-111)103-20-11-7-12-21-103/h7-100H,5-6H2,1-4H3
InChIKeyGHVWZXCZJPSYAN-UHFFFAOYSA-N
XLogP40.26
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds29
Heavy Atoms144
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001848.45
LogP ≤ 540.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline with MolForge

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Related Compounds

1-N,5-N-bis(4-butan-2-ylphenyl)-1-N,5-N-bis(4-phenylphenyl)naphthalene-1,5-diamine
CID 58426696
N-(4-butan-2-ylphenyl)-N-[4-(6-phenylnaphthalen-2-yl)phenyl]-3-tritioaniline
CID 59196951
ethane;4-(4-phenylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]aniline;4-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 158849032
4-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 134370557
4-phenyl-N-(4-phenylphenyl)-N-[4-[4-[4-[3-(4-phenylphenyl)phenyl]-N-[4-[3-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]phenyl]aniline
CID 58672379
4-phenyl-N-[4-(3-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 118314823
4-N-(4-butan-2-ylphenyl)-1-N,4-N-dinaphthalen-1-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine;4-N-(4-butan-2-ylphenyl)-4-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N-phenylbenzene-1,4-diamine;4-N-(4-butan-2-ylphenyl)-4-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine
CID 90967066
4-[6-[4-(4-butan-2-ylphenyl)phenyl]-9-(4-propan-2-ylphenyl)carbazol-3-yl]-N,N-diphenylaniline;N-[4-[6-[4-(4-butan-2-ylphenyl)phenyl]-9-(4-propan-2-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 161492117
N,N-diphenyl-4-[4-(N-[4-[3-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]anilino)phenyl]aniline
CID 59566446
N-(4-butan-2-ylphenyl)-3-methyl-N-phenylaniline;methane
CID 159095466
3-N-(4-butan-2-ylphenyl)-3-N-naphthalen-1-yl-1-N,1-N-diphenylbenzene-1,3-diamine
CID 59747058
N-[4-[6-(4-butan-2-ylphenyl)-9-phenylcarbazol-3-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 154597309

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline?
The IUPAC name of N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline (CID 59566466) is N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline.
What is the SMILES notation for N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline?
The canonical SMILES for N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline is CCC(C)c1ccc(N(c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)c2ccc(-c3cccc(-c4ccc(N(c5ccc(-c6ccc(N(c7ccc(-c8ccc(-c9ccccc9)cc8)cc7)c7ccc(-c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8)cc7)cc6)cc5)c5ccc(C(C)CC)cc5)cc4)c3)cc2)cc1.
What is the InChIKey of N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline?
The InChIKey is GHVWZXCZJPSYAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C140H110N4/c1-5-99(3)101-50-74-129(75-51-101)141(131-86-62-121(63-87-131)123-66-90-137(91-67-123)143(133-78-54-117(55-79-133)113-40-32-108(33-41-113)104-22-13-8-14-23-104)134-80-56-118(57-81-134)114-42-34-109(35-43-114)105-24-15-9-16-25-105)139-94-70-125(71-95-139)127-28-19-29-128(98-127)126-72-96-140(97-73-126)142(130-76-52-102(53-77-130)100(4)6-2)132-88-64-122(65-89-132)124-68-92-138(93-69-124)144(135-82-58-119(59-83-135)115-44-36-110(37-45-115)106-26-17-10-18-27-106)136-84-60-120(61-85-136)116-48-46-112(47-49-116)111-38-30-107(31-39-111)103-20-11-7-12-21-103/h7-100H,5-6H2,1-4H3.
What are the key properties of N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline?
N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline has a molecular weight of 1848.45 g/mol, XLogP of 40.26, 29 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 59566466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).