N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine

C82H58N4 — CID 59184359

IUPACN-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
SMILESCc1c(-c2ccccc2)c2cc(-c3ccc4c(c3)c(-c3ccccc3)c(C)n4-c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3)ccc2n1-c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C82H58N4/c1-55-81(61-21-5-3-6-22-61)77-53-67(33-47-79(77)83(55)69-39-43-71(44-40-69)85(73-35-29-57-17-9-13-25-63(57)49-73)74-36-30-58-18-10-14-26-64(58)50-74)68-34-48-80-78(54-68)82(62-23-7-4-8-24-62)56(2)84(80)70-41-45-72(46-42-70)86(75-37-31-59-19-11-15-27-65(59)51-75)76-38-32-60-20-12-16-28-66(60)52-76/h3-54H,1-2H3
InChIKeyNCLLVQWBBAGZJI-UHFFFAOYSA-N
MW1099.39 g/mol
LogP22.74
Rot. Bonds11

About N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine

N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine (PubChem CID 59184359) has the molecular formula C82H58N4 and a molecular weight of 1099.39 g/mol. Its IUPAC name is N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
PubChem CID59184359
Molecular FormulaC82H58N4
Molecular Weight1099.39 g/mol
Exact Mass1098.47
IUPAC NameN-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
SMILESCc1c(-c2ccccc2)c2cc(-c3ccc4c(c3)c(-c3ccccc3)c(C)n4-c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3)ccc2n1-c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C82H58N4/c1-55-81(61-21-5-3-6-22-61)77-53-67(33-47-79(77)83(55)69-39-43-71(44-40-69)85(73-35-29-57-17-9-13-25-63(57)49-73)74-36-30-58-18-10-14-26-64(58)50-74)68-34-48-80-78(54-68)82(62-23-7-4-8-24-62)56(2)84(80)70-41-45-72(46-42-70)86(75-37-31-59-19-11-15-27-65(59)51-75)76-38-32-60-20-12-16-28-66(60)52-76/h3-54H,1-2H3
InChIKeyNCLLVQWBBAGZJI-UHFFFAOYSA-N
XLogP22.74
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001099.39
LogP ≤ 522.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine with MolForge

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Related Compounds

4-[2-methyl-5-[2-methyl-3-phenyl-1-[4-(N-phenylanilino)phenyl]indol-5-yl]-3-phenylindol-1-yl]-N,N-diphenylaniline
CID 59184241
4-N-[4-[2-methyl-5-[2-methyl-3-phenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]indol-5-yl]-3-phenylindol-1-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 59184297
N-[4-[5-[2,3-dimethyl-1-[4-(4-methyl-N-naphthalen-2-ylanilino)phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-N-(4-methylphenyl)naphthalen-2-amine
CID 59184250
N-(4-naphthalen-2-ylphenyl)-6-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 166956432
bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine
CID 159121295
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
N-(4-naphthalen-2-ylphenyl)-4-[4-(10-phenylanthracen-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59288195
1-N,1-N,3-N,3-N-tetranaphthalen-2-yl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine
CID 129175591
3,6-bis[4-(4-carbazol-9-ylphenyl)phenyl]-9-naphthalen-2-ylcarbazole;N,N-diphenyl-4-[4-[6-[4-[4-(N-phenylanilino)phenyl]phenyl]-9-(4-phenylphenyl)carbazol-3-yl]phenyl]aniline
CID 159344155
N-(3,5-diphenylphenyl)-N-[4-[2-methyl-5-[2-methyl-1-[4-(N-naphthalen-1-yl-3,5-diphenylanilino)phenyl]-3-phenylindol-5-yl]-3-phenylindol-1-yl]phenyl]naphthalen-1-amine;N-[4-[2-methyl-5-[2-methyl-1-[4-(4-methyl-N-(3-phenylphenyl)anilino)phenyl]-3-phenylindol-5-yl]-3-phenylindol-1-yl]phenyl]-N-(4-methylphenyl)-3-phenylaniline;N-[4-[2-methyl-5-[2-methyl-3-phenyl-1-[4-(N-[4-(3-phenylphenyl)phenyl]anilino)phenyl]indol-5-yl]-3-phenylindol-1-yl]phenyl]-N-phenyl-4-(3-phenylphenyl)aniline
CID 159351263
N-[4-[5-[2,3-dimethyl-1-[4-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-4-methyl-N-(4-phenylphenyl)aniline;N-[4-[5-[2,3-dimethyl-1-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-N-naphthalen-1-ylnaphthalen-2-amine;N-[4-[5-[2,3-dimethyl-1-[4-(N-(4-phenylphenyl)anilino)phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-N,4-diphenylaniline
CID 158168687
N-(4-naphthalen-2-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 166956515

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
The IUPAC name of N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine (CID 59184359) is N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine.
What is the SMILES notation for N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
The canonical SMILES for N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine is Cc1c(-c2ccccc2)c2cc(-c3ccc4c(c3)c(-c3ccccc3)c(C)n4-c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3)ccc2n1-c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
The InChIKey is NCLLVQWBBAGZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C82H58N4/c1-55-81(61-21-5-3-6-22-61)77-53-67(33-47-79(77)83(55)69-39-43-71(44-40-69)85(73-35-29-57-17-9-13-25-63(57)49-73)74-36-30-58-18-10-14-26-64(58)50-74)68-34-48-80-78(54-68)82(62-23-7-4-8-24-62)56(2)84(80)70-41-45-72(46-42-70)86(75-37-31-59-19-11-15-27-65(59)51-75)76-38-32-60-20-12-16-28-66(60)52-76/h3-54H,1-2H3.
What are the key properties of N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine has a molecular weight of 1099.39 g/mol, XLogP of 22.74, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-[1-[4-(dinaphthalen-2-ylamino)phenyl]-2-methyl-3-phenylindol-5-yl]-2-methyl-3-phenylindol-1-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine is sourced from PubChem (CID 59184359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).