4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine

C46H34N2 — CID 59181360

IUPAC4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine
SMILESc1ccc(Nc2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c4ccccc34)cc2)cc1
InChIInChI=1S/C46H34N2/c1-4-12-34(13-5-1)36-22-28-41(29-23-36)48(42-30-24-37(25-31-42)35-14-6-2-7-15-35)46-33-32-43(44-18-10-11-19-45(44)46)38-20-26-40(27-21-38)47-39-16-8-3-9-17-39/h1-33,47H
InChIKeyJFJWBFRMRHQLBD-UHFFFAOYSA-N
MW614.79 g/mol
LogP13.05
Rot. Bonds8

About 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine

4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine (PubChem CID 59181360) has the molecular formula C46H34N2 and a molecular weight of 614.79 g/mol. Its IUPAC name is 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound Name4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine
PubChem CID59181360
Molecular FormulaC46H34N2
Molecular Weight614.79 g/mol
Exact Mass614.27
IUPAC Name4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine
SMILESc1ccc(Nc2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c4ccccc34)cc2)cc1
InChIInChI=1S/C46H34N2/c1-4-12-34(13-5-1)36-22-28-41(29-23-36)48(42-30-24-37(25-31-42)35-14-6-2-7-15-35)46-33-32-43(44-18-10-11-19-45(44)46)38-20-26-40(27-21-38)47-39-16-8-3-9-17-39/h1-33,47H
InChIKeyJFJWBFRMRHQLBD-UHFFFAOYSA-N
XLogP13.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500614.79
LogP ≤ 513.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-(4-triphenylsilylphenyl)naphthalen-1-amine
CID 123242691
N,4-diphenyl-N-[4-(6-phenylnaphthalen-2-yl)phenyl]naphthalen-1-amine
CID 139352916
4-(4-anilinophenyl)-3-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 69462597
4-N-[4-(4-anilinophenyl)phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 127255463
N-[3-(3,5-diphenylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)naphthalen-1-amine
CID 166974675
N-phenyl-4-[6-[4-(N-phenylanilino)phenyl]pyren-1-yl]aniline
CID 90215363
N,4-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]naphthalen-1-amine
CID 139352637
4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)naphthalen-1-amine
CID 153292219
N-[4-[4-(2-anilinophenyl)phenyl]phenyl]-5-chloro-N-phenylnaphthalen-1-amine
CID 67787000
ethane;N-[4-[4-(N-fluoranthen-3-ylanilino)phenyl]phenyl]-N-phenylfluoranthen-3-amine
CID 91567047
4-naphthalen-1-yl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 166589712
N,4-diphenyl-N-[4-[4-[4-(N-(4-phenylnaphthalen-1-yl)anilino)phenyl]phenyl]cyclohexa-1,3-dien-1-yl]naphthalen-1-amine
CID 121384299

Frequently Asked Questions

What is the IUPAC name of 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine?
The IUPAC name of 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine (CID 59181360) is 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine is c1ccc(Nc2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c4ccccc34)cc2)cc1.
What is the InChIKey of 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine?
The InChIKey is JFJWBFRMRHQLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H34N2/c1-4-12-34(13-5-1)36-22-28-41(29-23-36)48(42-30-24-37(25-31-42)35-14-6-2-7-15-35)46-33-32-43(44-18-10-11-19-45(44)46)38-20-26-40(27-21-38)47-39-16-8-3-9-17-39/h1-33,47H.
What are the key properties of 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine?
4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine has a molecular weight of 614.79 g/mol, XLogP of 13.05, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-anilinophenyl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 59181360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).