N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine

C51H35N — CID 177114125

IUPACN-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(Nc4ccc(-c5ccc6cccc(-c7ccc8ccccc8c7)c6c5)cc4)cccc32)cc1
InChIInChI=1S/C51H35N/c1-3-16-41(17-4-1)51(42-18-5-2-6-19-42)47-22-10-9-20-45(47)50-48(51)23-12-24-49(50)52-43-31-29-36(30-32-43)39-27-26-37-15-11-21-44(46(37)34-39)40-28-25-35-13-7-8-14-38(35)33-40/h1-34,52H
InChIKeyYAEOZBUXGSVIMR-UHFFFAOYSA-N
MW661.85 g/mol
LogP13.43
Rot. Bonds6

About N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine

N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine (PubChem CID 177114125) has the molecular formula C51H35N and a molecular weight of 661.85 g/mol. Its IUPAC name is N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine.

Molecular Properties

Compound NameN-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine
PubChem CID177114125
Molecular FormulaC51H35N
Molecular Weight661.85 g/mol
Exact Mass661.28
IUPAC NameN-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(Nc4ccc(-c5ccc6cccc(-c7ccc8ccccc8c7)c6c5)cc4)cccc32)cc1
InChIInChI=1S/C51H35N/c1-3-16-41(17-4-1)51(42-18-5-2-6-19-42)47-22-10-9-20-45(47)50-48(51)23-12-24-49(50)52-43-31-29-36(30-32-43)39-27-26-37-15-11-21-44(46(37)34-39)40-28-25-35-13-7-8-14-38(35)33-40/h1-34,52H
InChIKeyYAEOZBUXGSVIMR-UHFFFAOYSA-N
XLogP13.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500661.85
LogP ≤ 513.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-9,9-diphenylfluoren-4-amine
CID 172544729
N-(3-naphthalen-2-ylphenyl)-9,9'-spirobi[fluorene]-4-amine
CID 172544682
9,9-dimethyl-N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]fluoren-4-amine
CID 177114163
N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]-9,9-diphenylfluoren-2-amine
CID 177113841
9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine
CID 155297478
5-(4-naphthalen-2-ylnaphthalen-1-yl)-7,7-diphenylbenzo[c]fluorene
CID 166034342
N-[2-(4-naphthalen-1-ylphenyl)phenyl]-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169019649
N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 167247172
2-[4-[4-[(9,9-diphenylfluoren-4-yl)amino]phenyl]-9-(1-methylnaphthalen-2-yl)fluoren-9-yl]naphthalen-1-ol
CID 145292020
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169020362
9,9-diphenyl-N-(2-phenylphenyl)fluoren-4-amine
CID 155297416
9-(4-chlorophenyl)-4-naphthalen-2-yl-9-phenylfluorene
CID 176760045

Frequently Asked Questions

What is the IUPAC name of N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine?
The IUPAC name of N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine (CID 177114125) is N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine.
What is the SMILES notation for N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine?
The canonical SMILES for N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3c(Nc4ccc(-c5ccc6cccc(-c7ccc8ccccc8c7)c6c5)cc4)cccc32)cc1.
What is the InChIKey of N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine?
The InChIKey is YAEOZBUXGSVIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H35N/c1-3-16-41(17-4-1)51(42-18-5-2-6-19-42)47-22-10-9-20-45(47)50-48(51)23-12-24-49(50)52-43-31-29-36(30-32-43)39-27-26-37-15-11-21-44(46(37)34-39)40-28-25-35-13-7-8-14-38(35)33-40/h1-34,52H.
What are the key properties of N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine?
N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine has a molecular weight of 661.85 g/mol, XLogP of 13.43, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9-diphenylfluoren-4-amine is sourced from PubChem (CID 177114125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).