2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole

C55H39N — CID 142142857

IUPAC2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole
SMILESc1ccc(-c2cc3ccccc3cc2-c2ccc(C(c3ccccc3)(c3ccccc3)c3ccc(-c4cc5ccccc5n4-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C55H39N/c1-5-17-40(18-6-1)51-37-43-19-13-14-20-44(43)38-52(51)41-29-33-48(34-30-41)55(46-22-7-2-8-23-46,47-24-9-3-10-25-47)49-35-31-42(32-36-49)54-39-45-21-15-16-28-53(45)56(54)50-26-11-4-12-27-50/h1-39H
InChIKeyFLEKFGXFKFZWFE-UHFFFAOYSA-N
MW713.92 g/mol
LogP14.17
Rot. Bonds8

About 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole

2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole (PubChem CID 142142857) has the molecular formula C55H39N and a molecular weight of 713.92 g/mol. Its IUPAC name is 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole.

Molecular Properties

Compound Name2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole
PubChem CID142142857
Molecular FormulaC55H39N
Molecular Weight713.92 g/mol
Exact Mass713.31
IUPAC Name2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole
SMILESc1ccc(-c2cc3ccccc3cc2-c2ccc(C(c3ccccc3)(c3ccccc3)c3ccc(-c4cc5ccccc5n4-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C55H39N/c1-5-17-40(18-6-1)51-37-43-19-13-14-20-44(43)38-52(51)41-29-33-48(34-30-41)55(46-22-7-2-8-23-46,47-24-9-3-10-25-47)49-35-31-42(32-36-49)54-39-45-21-15-16-28-53(45)56(54)50-26-11-4-12-27-50/h1-39H
InChIKeyFLEKFGXFKFZWFE-UHFFFAOYSA-N
XLogP14.17
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500713.92
LogP ≤ 514.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-diphenyl-4-(1-phenylindol-2-yl)aniline
CID 59993805
1,2-bis(4-methylphenyl)indole
CID 151814608
1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole
CID 144508733
N-phenyl-N-[4-(2-phenylindol-1-yl)phenyl]-4-[4-(N-[4-(2-phenylindol-1-yl)phenyl]anilino)phenyl]aniline
CID 144768904
1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole
CID 71230374
1-(3-methylphenyl)-2-phenylindole
CID 101372494
6-[4-(2-phenylindol-1-yl)phenyl]-2,4-bis(4-phenylphenyl)benzo[h]quinoline
CID 121441288
2-[7-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenanthren-2-yl]-1-phenylindole
CID 144756297
2-phenyl-1-pyridin-3-ylindole
CID 59214542
3-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]-9-(4-tritylphenyl)carbazole
CID 130231251
9-phenyl-3-[9-(3-phenylphenyl)carbazol-3-yl]-6-tritylcarbazole
CID 130230832
N-phenyl-N-[4-(1-phenylindol-2-yl)phenyl]naphthalen-1-amine
CID 145013973

Frequently Asked Questions

What is the IUPAC name of 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole?
The IUPAC name of 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole (CID 142142857) is 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole.
What is the SMILES notation for 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole?
The canonical SMILES for 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole is c1ccc(-c2cc3ccccc3cc2-c2ccc(C(c3ccccc3)(c3ccccc3)c3ccc(-c4cc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole?
The InChIKey is FLEKFGXFKFZWFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H39N/c1-5-17-40(18-6-1)51-37-43-19-13-14-20-44(43)38-52(51)41-29-33-48(34-30-41)55(46-22-7-2-8-23-46,47-24-9-3-10-25-47)49-35-31-42(32-36-49)54-39-45-21-15-16-28-53(45)56(54)50-26-11-4-12-27-50/h1-39H.
What are the key properties of 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole?
2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole has a molecular weight of 713.92 g/mol, XLogP of 14.17, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole is sourced from PubChem (CID 142142857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).