N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine

C52H39NSi — CID 59720596

IUPACN-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C52H39NSi/c1-5-15-40(16-6-1)42-25-32-46(33-26-42)53(48-36-29-41-17-13-14-18-45(41)39-48)47-34-27-43(28-35-47)44-30-37-52(38-31-44)54(49-19-7-2-8-20-49,50-21-9-3-10-22-50)51-23-11-4-12-24-51/h1-39H
InChIKeyHBNQHAJADWPXBA-UHFFFAOYSA-N
MW705.98 g/mol
LogP11.02
Rot. Bonds9

About N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine

N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine (PubChem CID 59720596) has the molecular formula C52H39NSi and a molecular weight of 705.98 g/mol. Its IUPAC name is N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine.

Molecular Properties

Compound NameN-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine
PubChem CID59720596
Molecular FormulaC52H39NSi
Molecular Weight705.98 g/mol
Exact Mass705.29
IUPAC NameN-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C52H39NSi/c1-5-15-40(16-6-1)42-25-32-46(33-26-42)53(48-36-29-41-17-13-14-18-45(41)39-48)47-34-27-43(28-35-47)44-30-37-52(38-31-44)54(49-19-7-2-8-20-49,50-21-9-3-10-22-50)51-23-11-4-12-24-51/h1-39H
InChIKeyHBNQHAJADWPXBA-UHFFFAOYSA-N
XLogP11.02
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500705.98
LogP ≤ 511.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

N-(4-phenylphenyl)-N-(4-triphenylsilylphenyl)phenanthren-2-amine
CID 164747918
N-[4-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 59029881
N-[4-[4-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 58905935
N,N-bis[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]naphthalen-2-amine;N,N-diphenyl-4-[4-(N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline
CID 160607838
N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-trimethylsilylphenyl)naphthalen-2-amine
CID 165040481
2-N,6-N,6-N-triphenyl-2-N-(4-phenylphenyl)naphthalene-2,6-diamine
CID 166917050
N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
N-[4-[3-[3-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 121286442
4-[3,5-bis[4-(N-phenylanilino)phenyl]phenyl]-N,N-diphenylaniline;4-N-naphthalen-2-yl-1-N,1-N-bis[4-(N-naphthalen-2-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 161230794
N-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 153292153
N-phenyl-6-[4-(N-(4-phenylphenyl)anilino)phenyl]-N-[6-[4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-2-yl]naphthalen-2-amine
CID 59690791
N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-methylnaphthalen-2-amine;N-[4-[4-(N-methyl-4-phenylanilino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 161479413

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine?
The IUPAC name of N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine (CID 59720596) is N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine.
What is the SMILES notation for N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine?
The canonical SMILES for N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc4ccccc4c3)cc2)cc1.
What is the InChIKey of N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine?
The InChIKey is HBNQHAJADWPXBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H39NSi/c1-5-15-40(16-6-1)42-25-32-46(33-26-42)53(48-36-29-41-17-13-14-18-45(41)39-48)47-34-27-43(28-35-47)44-30-37-52(38-31-44)54(49-19-7-2-8-20-49,50-21-9-3-10-22-50)51-23-11-4-12-24-51/h1-39H.
What are the key properties of N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine?
N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine has a molecular weight of 705.98 g/mol, XLogP of 11.02, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]naphthalen-2-amine is sourced from PubChem (CID 59720596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).