N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine

C46H32N2 — CID 59098802

IUPACN-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine
SMILESc1ccc(-c2c(-c3ccccc3)n(-c3ccc(N(c4ccc5ccccc5c4)c4cccc5ccccc45)cc3)c3ccccc23)cc1
InChIInChI=1S/C46H32N2/c1-3-16-35(17-4-1)45-42-23-11-12-24-44(42)48(46(45)36-18-5-2-6-19-36)39-30-28-38(29-31-39)47(40-27-26-33-14-7-8-20-37(33)32-40)43-25-13-21-34-15-9-10-22-41(34)43/h1-32H
InChIKeyJBTAYYYEOGHINC-UHFFFAOYSA-N
MW612.78 g/mol
LogP12.74
Rot. Bonds6

About N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine

N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine (PubChem CID 59098802) has the molecular formula C46H32N2 and a molecular weight of 612.78 g/mol. Its IUPAC name is N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine
PubChem CID59098802
Molecular FormulaC46H32N2
Molecular Weight612.78 g/mol
Exact Mass612.26
IUPAC NameN-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine
SMILESc1ccc(-c2c(-c3ccccc3)n(-c3ccc(N(c4ccc5ccccc5c4)c4cccc5ccccc45)cc3)c3ccccc23)cc1
InChIInChI=1S/C46H32N2/c1-3-16-35(17-4-1)45-42-23-11-12-24-44(42)48(46(45)36-18-5-2-6-19-36)39-30-28-38(29-31-39)47(40-27-26-33-14-7-8-20-37(33)32-40)43-25-13-21-34-15-9-10-22-41(34)43/h1-32H
InChIKeyJBTAYYYEOGHINC-UHFFFAOYSA-N
XLogP12.74
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500612.78
LogP ≤ 512.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-1-yl-N-[4-[5-[1-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]-2,3-diphenylindol-5-yl]-2,3-diphenylindol-1-yl]phenyl]naphthalen-2-amine
CID 59184224
4-(4-carbazol-9-ylphenyl)-N,N-diphenylaniline;4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,4-diphenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-2-amine
CID 159528912
N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;9-phenylcarbazole
CID 158239659
N-naphthalen-2-yl-N-[4-[1-phenyl-2,3-bis(4-phenylphenyl)indol-6-yl]phenyl]naphthalen-2-amine
CID 118459327
N-naphthalen-1-yl-N-[4-[10-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]anthracen-9-yl]phenyl]naphthalen-2-amine
CID 58758001
9-(4-carbazol-9-ylphenyl)-N-naphthalen-1-yl-N-(4-phenylphenyl)carbazol-3-amine
CID 158694626
N-(4-carbazol-9-ylphenyl)-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]naphthalen-2-amine
CID 168790189
N-naphthalen-1-yl-9-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine
CID 58850657
N-[4-[5-[1-[4-[(9,9-dimethylfluoren-2-yl)-naphthalen-1-ylamino]phenyl]-2,3-diphenylindol-5-yl]-2,3-diphenylindol-1-yl]phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
CID 59184343
2,6-dinaphthalen-2-yl-1,3,5,7-tetraphenylpyrrolo[2,3-f]indole;N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine;1-methyl-2-[4-[4-(1-methyl-3-phenylpyrrolo[3,2-g]quinolin-2-yl)phenyl]phenyl]-3-phenylpyrrolo[3,2-g]quinoline;N-[4-(1-methyl-3-phenylindol-2-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine;3-naphthalen-1-yl-2-[4-(3-naphthalen-1-yl-1-phenylindol-2-yl)phenyl]-1-phenylindole
CID 159921632
N-naphthalen-2-yl-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]naphthalen-1-yl]-9-phenylcarbazol-3-amine
CID 70938071
N-naphthalen-2-yl-N-[4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]naphthalen-1-yl]-9-phenylcarbazol-3-amine
CID 59181361

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine?
The IUPAC name of N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine (CID 59098802) is N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine.
What is the SMILES notation for N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine?
The canonical SMILES for N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine is c1ccc(-c2c(-c3ccccc3)n(-c3ccc(N(c4ccc5ccccc5c4)c4cccc5ccccc45)cc3)c3ccccc23)cc1.
What is the InChIKey of N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine?
The InChIKey is JBTAYYYEOGHINC-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H32N2/c1-3-16-35(17-4-1)45-42-23-11-12-24-44(42)48(46(45)36-18-5-2-6-19-36)39-30-28-38(29-31-39)47(40-27-26-33-14-7-8-20-37(33)32-40)43-25-13-21-34-15-9-10-22-41(34)43/h1-32H.
What are the key properties of N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine?
N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine has a molecular weight of 612.78 g/mol, XLogP of 12.74, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,3-diphenylindol-1-yl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine is sourced from PubChem (CID 59098802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).