4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine

C200H149N9 — CID 158863365

IUPAC4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine
SMILESC(=C(c1ccccc1)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12.C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12.C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C72H53N3.C66H49N3.C62H47N3/c1-7-21-54(22-8-1)55-35-37-58(38-36-55)72(56-23-9-2-10-24-56)53-59-41-52-70(71-34-20-19-33-69(59)71)57-39-42-64(43-40-57)75(67-48-44-65(45-49-67)73(60-25-11-3-12-26-60)61-27-13-4-14-28-61)68-50-46-66(47-51-68)74(62-29-15-5-16-30-62)63-31-17-6-18-32-63;1-7-21-50(22-8-1)66(51-23-9-2-10-24-51)49-53-37-48-64(65-34-20-19-33-63(53)65)52-35-38-58(39-36-52)69(61-44-40-59(41-45-61)67(54-25-11-3-12-26-54)55-27-13-4-14-28-55)62-46-42-60(43-47-62)68(56-29-15-5-16-30-56)57-31-17-6-18-32-57;1-7-19-51(20-8-1)62(52-21-9-2-10-22-52)47-48-31-33-49(34-32-48)50-35-37-57(38-36-50)65(60-43-39-58(40-44-60)63(53-23-11-3-12-24-53)54-25-13-4-14-26-54)61-45-41-59(42-46-61)64(55-27-15-5-16-28-55)56-29-17-6-18-30-56/h1-53H;1-49H;1-47H
InChIKeyJAXPUEOMIHPYAB-UHFFFAOYSA-N
MW2678.45 g/mol
LogP56.03
Rot. Bonds40

About 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine

4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine (PubChem CID 158863365) has the molecular formula C200H149N9 and a molecular weight of 2678.45 g/mol. Its IUPAC name is 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine.

Molecular Properties

Compound Name4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine
PubChem CID158863365
Molecular FormulaC200H149N9
Molecular Weight2678.45 g/mol
Exact Mass2676.19
IUPAC Name4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine
SMILESC(=C(c1ccccc1)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12.C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12.C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C72H53N3.C66H49N3.C62H47N3/c1-7-21-54(22-8-1)55-35-37-58(38-36-55)72(56-23-9-2-10-24-56)53-59-41-52-70(71-34-20-19-33-69(59)71)57-39-42-64(43-40-57)75(67-48-44-65(45-49-67)73(60-25-11-3-12-26-60)61-27-13-4-14-28-61)68-50-46-66(47-51-68)74(62-29-15-5-16-30-62)63-31-17-6-18-32-63;1-7-21-50(22-8-1)66(51-23-9-2-10-24-51)49-53-37-48-64(65-34-20-19-33-63(53)65)52-35-38-58(39-36-52)69(61-44-40-59(41-45-61)67(54-25-11-3-12-26-54)55-27-13-4-14-28-55)62-46-42-60(43-47-62)68(56-29-15-5-16-30-56)57-31-17-6-18-32-57;1-7-19-51(20-8-1)62(52-21-9-2-10-22-52)47-48-31-33-49(34-32-48)50-35-37-57(38-36-50)65(60-43-39-58(40-44-60)63(53-23-11-3-12-24-53)54-25-13-4-14-26-54)61-45-41-59(42-46-61)64(55-27-15-5-16-28-55)56-29-17-6-18-30-56/h1-53H;1-49H;1-47H
InChIKeyJAXPUEOMIHPYAB-UHFFFAOYSA-N
XLogP56.03
TPSA29.16 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds40
Heavy Atoms209
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002678.45
LogP ≤ 556.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine with MolForge

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Related Compounds

4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine
CID 22983512
N,N-diphenyl-4-[2-phenyl-2-[4-[1-phenyl-2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]ethenyl]aniline
CID 68997880
4-[2,2-bis(4-methylphenyl)ethenyl]-N-[4-(2,2-diphenylethenyl)phenyl]-N-phenylnaphthalen-1-amine;4-(2,2-diphenylethenyl)-N-[4-(2,2-diphenylethenyl)phenyl]-N-phenylnaphthalen-1-amine
CID 157429569
4-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]-N,N-diphenylaniline
CID 23067335
4-[2,2-bis(4-methylphenyl)ethenyl]-N-[4-(2,2-diphenylethenyl)phenyl]-N-(4-methylphenyl)naphthalen-1-amine;4-(2,2-diphenylethenyl)-N-[4-(2,2-diphenylethenyl)phenyl]-N-(4-methylphenyl)naphthalen-1-amine
CID 161213338
4-(2,2-diphenylethenyl)-N,N-diphenylaniline;4-(2,2-diphenylethenyl)-N-[4-(2,2-diphenylethenyl)phenyl]-N-phenylaniline;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-(2-phenylethenyl)aniline;ethane
CID 158855381
4-[(E)-2-(4-methoxyphenyl)-2-phenylethenyl]-N-[4-[4-(N-[4-[(E)-2-(4-methoxyphenyl)-2-phenylethenyl]phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 163442886
4-methyl-N-(4-methylphenyl)-N-[4-[(E)-2-(4-methylphenyl)-1-phenylethenyl]phenyl]aniline
CID 58841601
[4-[(Z)-2-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)phenyl]anilino]phenyl]-1-phenylethenyl]phenyl]methanol
CID 146521934
1-(1,2-diphenylethenyl)-4-phenylbenzene
CID 54005685
4-[3-(N-[4-[2,2-bis(4-methylphenyl)ethenyl]phenyl]anilino)phenyl]-3-methyl-N,N-diphenylaniline
CID 163491704
4-[(Z)-2-[4-[4-[(E)-2-[4-(diethylamino)phenyl]-2-phenylethenyl]phenyl]phenyl]-1-phenylethenyl]-N,N-diethylaniline
CID 59935150

Frequently Asked Questions

What is the IUPAC name of 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine?
The IUPAC name of 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine (CID 158863365) is 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine.
What is the SMILES notation for 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine?
The canonical SMILES for 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine is C(=C(c1ccccc1)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12.C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12.C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine?
The InChIKey is JAXPUEOMIHPYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H53N3.C66H49N3.C62H47N3/c1-7-21-54(22-8-1)55-35-37-58(38-36-55)72(56-23-9-2-10-24-56)53-59-41-52-70(71-34-20-19-33-69(59)71)57-39-42-64(43-40-57)75(67-48-44-65(45-49-67)73(60-25-11-3-12-26-60)61-27-13-4-14-28-61)68-50-46-66(47-51-68)74(62-29-15-5-16-30-62)63-31-17-6-18-32-63;1-7-21-50(22-8-1)66(51-23-9-2-10-24-51)49-53-37-48-64(65-34-20-19-33-63(53)65)52-35-38-58(39-36-52)69(61-44-40-59(41-45-61)67(54-25-11-3-12-26-54)55-27-13-4-14-28-55)62-46-42-60(43-47-62)68(56-29-15-5-16-30-56)57-31-17-6-18-32-57;1-7-19-51(20-8-1)62(52-21-9-2-10-22-52)47-48-31-33-49(34-32-48)50-35-37-57(38-36-50)65(60-43-39-58(40-44-60)63(53-23-11-3-12-24-53)54-25-13-4-14-26-54)61-45-41-59(42-46-61)64(55-27-15-5-16-28-55)56-29-17-6-18-30-56/h1-53H;1-49H;1-47H.
What are the key properties of 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine?
4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine has a molecular weight of 2678.45 g/mol, XLogP of 56.03, 40 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-[4-[4-(2,2-diphenylethenyl)phenyl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[4-[2-phenyl-2-(4-phenylphenyl)ethenyl]naphthalen-1-yl]phenyl]benzene-1,4-diamine is sourced from PubChem (CID 158863365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).