N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine

C155H105N3OS — CID 158452934

IUPACN-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine
SMILESc1ccc(-c2cc(-c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cc(-c5ccccc5)c5ccccc5c4)cc3)c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cc(-c5ccccc5)c5ccccc5c4)cc3)c3cccc4sc5ccccc5c34)cc2)cc1
InChIInChI=1S/C63H43N.C46H31NO.C46H31NS/c1-4-18-46(19-5-1)58-43-49(42-48-21-11-13-28-56(48)58)44-34-38-52(39-35-44)64(53-40-36-47(37-41-53)55-30-16-22-45-20-10-12-27-54(45)55)61-33-17-32-60-62(61)57-29-14-15-31-59(57)63(60,50-23-6-2-7-24-50)51-25-8-3-9-26-51;2*1-3-12-32(13-4-1)33-22-26-38(27-23-33)47(43-19-11-21-45-46(43)41-18-9-10-20-44(41)48-45)39-28-24-34(25-29-39)37-30-36-16-7-8-17-40(36)42(31-37)35-14-5-2-6-15-35/h1-43H;2*1-31H
InChIKeyHEFJEVGLYVCUKA-UHFFFAOYSA-N
MW2057.63 g/mol
LogP43.72
Rot. Bonds20

About N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine

N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine (PubChem CID 158452934) has the molecular formula C155H105N3OS and a molecular weight of 2057.63 g/mol. Its IUPAC name is N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine.

Molecular Properties

Compound NameN-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine
PubChem CID158452934
Molecular FormulaC155H105N3OS
Molecular Weight2057.63 g/mol
Exact Mass2055.80
IUPAC NameN-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine
SMILESc1ccc(-c2cc(-c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cc(-c5ccccc5)c5ccccc5c4)cc3)c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cc(-c5ccccc5)c5ccccc5c4)cc3)c3cccc4sc5ccccc5c34)cc2)cc1
InChIInChI=1S/C63H43N.C46H31NO.C46H31NS/c1-4-18-46(19-5-1)58-43-49(42-48-21-11-13-28-56(48)58)44-34-38-52(39-35-44)64(53-40-36-47(37-41-53)55-30-16-22-45-20-10-12-27-54(45)55)61-33-17-32-60-62(61)57-29-14-15-31-59(57)63(60,50-23-6-2-7-24-50)51-25-8-3-9-26-51;2*1-3-12-32(13-4-1)33-22-26-38(27-23-33)47(43-19-11-21-45-46(43)41-18-9-10-20-44(41)48-45)39-28-24-34(25-29-39)37-30-36-16-7-8-17-40(36)42(31-37)35-14-5-2-6-15-35/h1-43H;2*1-31H
InChIKeyHEFJEVGLYVCUKA-UHFFFAOYSA-N
XLogP43.72
TPSA22.86 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds20
Heavy Atoms160
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002057.63
LogP ≤ 543.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine?
The IUPAC name of N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine (CID 158452934) is N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine.
What is the SMILES notation for N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine?
The canonical SMILES for N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine is c1ccc(-c2cc(-c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)cc3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cc(-c5ccccc5)c5ccccc5c4)cc3)c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cc(-c5ccccc5)c5ccccc5c4)cc3)c3cccc4sc5ccccc5c34)cc2)cc1.
What is the InChIKey of N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine?
The InChIKey is HEFJEVGLYVCUKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H43N.C46H31NO.C46H31NS/c1-4-18-46(19-5-1)58-43-49(42-48-21-11-13-28-56(48)58)44-34-38-52(39-35-44)64(53-40-36-47(37-41-53)55-30-16-22-45-20-10-12-27-54(45)55)61-33-17-32-60-62(61)57-29-14-15-31-59(57)63(60,50-23-6-2-7-24-50)51-25-8-3-9-26-51;2*1-3-12-32(13-4-1)33-22-26-38(27-23-33)47(43-19-11-21-45-46(43)41-18-9-10-20-44(41)48-45)39-28-24-34(25-29-39)37-30-36-16-7-8-17-40(36)42(31-37)35-14-5-2-6-15-35/h1-43H;2*1-31H.
What are the key properties of N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine?
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine has a molecular weight of 2057.63 g/mol, XLogP of 43.72, 20 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]fluoren-4-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(4-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-1-amine is sourced from PubChem (CID 158452934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).