N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine

C53H37N3 — CID 118245852

IUPACN-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4c(c3)C(c3cccnc3)(c3cccnc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C53H37N3/c1-3-12-38(13-4-1)40-22-26-46(27-23-40)56(47-28-24-41(25-29-47)43-17-9-16-42(34-43)39-14-5-2-6-15-39)48-30-31-50-49-20-7-8-21-51(49)53(52(50)35-48,44-18-10-32-54-36-44)45-19-11-33-55-37-45/h1-37H
InChIKeyQZCFOGGMCZNWTR-UHFFFAOYSA-N
MW715.90 g/mol
LogP13.31
Rot. Bonds8

About N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine

N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine (PubChem CID 118245852) has the molecular formula C53H37N3 and a molecular weight of 715.90 g/mol. Its IUPAC name is N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine.

Molecular Properties

Compound NameN-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine
PubChem CID118245852
Molecular FormulaC53H37N3
Molecular Weight715.90 g/mol
Exact Mass715.30
IUPAC NameN-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4c(c3)C(c3cccnc3)(c3cccnc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C53H37N3/c1-3-12-38(13-4-1)40-22-26-46(27-23-40)56(47-28-24-41(25-29-47)43-17-9-16-42(34-43)39-14-5-2-6-15-39)48-30-31-50-49-20-7-8-21-51(49)53(52(50)35-48,44-18-10-32-54-36-44)45-19-11-33-55-37-45/h1-37H
InChIKeyQZCFOGGMCZNWTR-UHFFFAOYSA-N
XLogP13.31
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.90
LogP ≤ 513.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,2-N,2-N'-tris(4-phenylphenyl)-2-N'-[4-[3-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]-2,2'-diamine
CID 138662093
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-3-amine;N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-3-amine
CID 161038033
N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine
CID 130263967
N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 166566308
3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)-5-[3-(3-pyridin-3-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 164785730
N-(9,9-diphenylfluoren-2-yl)-9,9-diphenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 118298160
N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 118641092
N-(9,9-diphenylfluoren-3-yl)-9,9-diphenyl-N-[3-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 121423591
N-[4-[4-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine
CID 166565630
3-[3-[3-(9,9-diphenylfluoren-2-yl)-5-[3-(5-pyridin-3-yl-3-pyridinyl)phenyl]phenyl]phenyl]-5-pyridin-3-ylpyridine
CID 155116760

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine?
The IUPAC name of N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine (CID 118245852) is N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine.
What is the SMILES notation for N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine?
The canonical SMILES for N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine is c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4c(c3)C(c3cccnc3)(c3cccnc3)c3ccccc3-4)cc2)cc1.
What is the InChIKey of N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine?
The InChIKey is QZCFOGGMCZNWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H37N3/c1-3-12-38(13-4-1)40-22-26-46(27-23-40)56(47-28-24-41(25-29-47)43-17-9-16-42(34-43)39-14-5-2-6-15-39)48-30-31-50-49-20-7-8-21-51(49)53(52(50)35-48,44-18-10-32-54-36-44)45-19-11-33-55-37-45/h1-37H.
What are the key properties of N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine?
N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine has a molecular weight of 715.90 g/mol, XLogP of 13.31, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine is sourced from PubChem (CID 118245852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).