N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine

C46H35N — CID 143944265

IUPACN-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESc1ccc(CC(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C46H35N/c1-3-13-34(14-4-1)33-45(44-23-11-17-37-15-7-9-21-42(37)44)39-27-25-35(26-28-39)36-29-31-41(32-30-36)47(40-19-5-2-6-20-40)46-24-12-18-38-16-8-10-22-43(38)46/h1-32,45H,33H2
InChIKeyVXPAAUHFPCGTIW-UHFFFAOYSA-N
MW601.79 g/mol
LogP12.50
Rot. Bonds8

About N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine

N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 143944265) has the molecular formula C46H35N and a molecular weight of 601.79 g/mol. Its IUPAC name is N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

Compound NameN-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
PubChem CID143944265
Molecular FormulaC46H35N
Molecular Weight601.79 g/mol
Exact Mass601.28
IUPAC NameN-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESc1ccc(CC(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C46H35N/c1-3-13-34(14-4-1)33-45(44-23-11-17-37-15-7-9-21-42(37)44)39-27-25-35(26-28-39)36-29-31-41(32-30-36)47(40-19-5-2-6-20-40)46-24-12-18-38-16-8-10-22-43(38)46/h1-32,45H,33H2
InChIKeyVXPAAUHFPCGTIW-UHFFFAOYSA-N
XLogP12.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500601.79
LogP ≤ 512.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1'-biphenyl;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 172802336
1-N,4-N-dinaphthalen-1-yl-4-N-[4-[4-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]phenyl]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 58612738
N-[4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 59650467
N-[4-[4-[N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-4-[4-[4-(N-[4-[4-(N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 155471012
N,N-diphenyl-4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]aniline;N-phenyl-4-(4-phenylphenyl)-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;N-phenyl-N-[4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]phenyl]naphthalen-1-amine
CID 160952409
N-[4-[4-(N-[4-[4-[N-naphthalen-1-yl-4-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]phenyl]-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 58713806
N-[4-[4-(N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 161384258
N-[4-[4-[4-(N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-4-phenylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-[4-(N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]aniline
CID 162077665
N-(4-phenylphenyl)-N-[4-[4-[4-(N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]naphthalen-1-amine
CID 58729730
N-phenyl-N-[4-[4-(4-phenyl-N-[4-[4-[4-[4-(4-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]phenyl]anilino)phenyl]phenyl]naphthalen-1-amine
CID 134455282
N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 90694175
carbanide;copper;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 58224687

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The IUPAC name of N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine (CID 143944265) is N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine.
What is the SMILES notation for N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The canonical SMILES for N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine is c1ccc(CC(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The InChIKey is VXPAAUHFPCGTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H35N/c1-3-13-34(14-4-1)33-45(44-23-11-17-37-15-7-9-21-42(37)44)39-27-25-35(26-28-39)36-29-31-41(32-30-36)47(40-19-5-2-6-20-40)46-24-12-18-38-16-8-10-22-43(38)46/h1-32,45H,33H2.
What are the key properties of N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 601.79 g/mol, XLogP of 12.50, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 143944265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).