N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline

C154H117N3 — CID 158364670

IUPACN-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline
SMILES[2H]c1c([2H])c([2H])c2c([2H])c(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)c(-c3ccccc3)c([2H])c2c1[2H].c1ccc(-c2ccc(-c3cc4ccccc4cc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5ccccc5cc4-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3)cc2)cc1
InChIInChI=1S/C56H47N.C52H37N.C46H33N/c1-3-9-42(10-4-1)44-17-25-51(26-18-44)57(52-27-19-45(20-28-52)43-11-5-2-6-12-43)53-29-21-47(22-30-53)55-35-49-14-8-7-13-48(49)34-54(55)46-15-23-50(24-16-46)56-36-39-31-40(37-56)33-41(32-39)38-56;1-4-12-38(13-5-1)41-20-22-44(23-21-41)51-36-46-18-10-11-19-47(46)37-52(51)45-28-34-50(35-29-45)53(48-30-24-42(25-31-48)39-14-6-2-7-15-39)49-32-26-43(27-33-49)40-16-8-3-9-17-40;1-4-12-34(13-5-1)36-20-26-42(27-21-36)47(43-28-22-37(23-29-43)35-14-6-2-7-15-35)44-30-24-39(25-31-44)46-33-41-19-11-10-18-40(41)32-45(46)38-16-8-3-9-17-38/h1-30,34-35,39-41H,31-33,36-38H2;1-37H;1-33H/i;;10D,11D,18D,19D,32D,33D
InChIKeyGTWRDFRCVVGSEF-UXDFHMEJSA-N
MW2015.69 g/mol
LogP43.07
Rot. Bonds23

About N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline

N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline (PubChem CID 158364670) has the molecular formula C154H117N3 and a molecular weight of 2015.69 g/mol. Its IUPAC name is N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline.

Molecular Properties

Compound NameN-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline
PubChem CID158364670
Molecular FormulaC154H117N3
Molecular Weight2015.69 g/mol
Exact Mass2013.96
IUPAC NameN-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline
SMILES[2H]c1c([2H])c([2H])c2c([2H])c(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)c(-c3ccccc3)c([2H])c2c1[2H].c1ccc(-c2ccc(-c3cc4ccccc4cc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5ccccc5cc4-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3)cc2)cc1
InChIInChI=1S/C56H47N.C52H37N.C46H33N/c1-3-9-42(10-4-1)44-17-25-51(26-18-44)57(52-27-19-45(20-28-52)43-11-5-2-6-12-43)53-29-21-47(22-30-53)55-35-49-14-8-7-13-48(49)34-54(55)46-15-23-50(24-16-46)56-36-39-31-40(37-56)33-41(32-39)38-56;1-4-12-38(13-5-1)41-20-22-44(23-21-41)51-36-46-18-10-11-19-47(46)37-52(51)45-28-34-50(35-29-45)53(48-30-24-42(25-31-48)39-14-6-2-7-15-39)49-32-26-43(27-33-49)40-16-8-3-9-17-40;1-4-12-34(13-5-1)36-20-26-42(27-21-36)47(43-28-22-37(23-29-43)35-14-6-2-7-15-35)44-30-24-39(25-31-44)46-33-41-19-11-10-18-40(41)32-45(46)38-16-8-3-9-17-38/h1-30,34-35,39-41H,31-33,36-38H2;1-37H;1-33H/i;;10D,11D,18D,19D,32D,33D
InChIKeyGTWRDFRCVVGSEF-UXDFHMEJSA-N
XLogP43.07
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds23
Heavy Atoms157
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002015.69
LogP ≤ 543.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline with MolForge

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Related Compounds

N-[4-[6-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 139352768
N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-N,4-diphenylaniline
CID 176590504
N-[4-[4-[N-[4-(1-adamantyl)phenyl]-4-(4-methylphenyl)anilino]phenyl]phenyl]-3,4-diphenyl-N-(4-phenylphenyl)aniline
CID 164768070
2-N-[4-(1-adamantyl)phenyl]-9,9-dimethyl-7-N,7-N-diphenyl-2-N-(4-phenylphenyl)fluorene-2,7-diamine
CID 164768061
N-[4-[4-[4-(1-adamantyl)phenyl]phenyl]phenyl]-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine
CID 130203842
N-[4-(1-adamantyl)phenyl]-4-(9,9-dimethylfluoren-2-yl)-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 169028657
N-[4-[4-(1-adamantyl)phenyl]phenyl]-2-naphthalen-1-yl-N-(4-phenylphenyl)aniline
CID 130197529
4-[4-(1-adamantyl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 169028585
N-[4-(1-adamantyl)phenyl]-N-(3-phenanthren-9-ylphenyl)-2,5-diphenylaniline
CID 177079809
3-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-N-[4-(1-tricyclo[3.3.1.03,7]nonanyl)phenyl]aniline
CID 155421593
N-[4-[7-(1-adamantyl)-9,9-dimethylfluoren-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 145346070
N-[4-[4-(1-adamantyl)phenyl]phenyl]-9,9-dimethyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 169028701

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline?
The IUPAC name of N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline (CID 158364670) is N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline.
What is the SMILES notation for N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline?
The canonical SMILES for N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline is [2H]c1c([2H])c([2H])c2c([2H])c(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)c(-c3ccccc3)c([2H])c2c1[2H].c1ccc(-c2ccc(-c3cc4ccccc4cc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5ccccc5cc4-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3)cc2)cc1.
What is the InChIKey of N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline?
The InChIKey is GTWRDFRCVVGSEF-UXDFHMEJSA-N. The full InChI is InChI=1S/C56H47N.C52H37N.C46H33N/c1-3-9-42(10-4-1)44-17-25-51(26-18-44)57(52-27-19-45(20-28-52)43-11-5-2-6-12-43)53-29-21-47(22-30-53)55-35-49-14-8-7-13-48(49)34-54(55)46-15-23-50(24-16-46)56-36-39-31-40(37-56)33-41(32-39)38-56;1-4-12-38(13-5-1)41-20-22-44(23-21-41)51-36-46-18-10-11-19-47(46)37-52(51)45-28-34-50(35-29-45)53(48-30-24-42(25-31-48)39-14-6-2-7-15-39)49-32-26-43(27-33-49)40-16-8-3-9-17-40;1-4-12-34(13-5-1)36-20-26-42(27-21-36)47(43-28-22-37(23-29-43)35-14-6-2-7-15-35)44-30-24-39(25-31-44)46-33-41-19-11-10-18-40(41)32-45(46)38-16-8-3-9-17-38/h1-30,34-35,39-41H,31-33,36-38H2;1-37H;1-33H/i;;10D,11D,18D,19D,32D,33D.
What are the key properties of N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline?
N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline has a molecular weight of 2015.69 g/mol, XLogP of 43.07, 23 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-[4-(1-adamantyl)phenyl]naphthalen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1,4,5,6,7,8-hexadeuterio-3-phenylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]aniline is sourced from PubChem (CID 158364670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).