N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

C59H45N — CID 166977720

IUPACN-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
SMILESC=Cc1ccc(CC2(Cc3ccc(C=C)cc3)c3ccccc3-c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)cc4)cc32)cc1
InChIInChI=1S/C59H45N/c1-3-42-21-25-44(26-22-42)40-59(41-45-27-23-43(4-2)24-28-45)56-19-11-10-18-54(56)55-38-33-50(39-57(55)59)48-31-36-52(37-32-48)60(58-20-12-16-49-15-8-9-17-53(49)58)51-34-29-47(30-35-51)46-13-6-5-7-14-46/h3-39H,1-2,40-41H2
InChIKeyYNBWFEFWFZFFAL-UHFFFAOYSA-N
MW768.02 g/mol
LogP15.68
Rot. Bonds11

About N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine (PubChem CID 166977720) has the molecular formula C59H45N and a molecular weight of 768.02 g/mol. Its IUPAC name is N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
PubChem CID166977720
Molecular FormulaC59H45N
Molecular Weight768.02 g/mol
Exact Mass767.36
IUPAC NameN-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
SMILESC=Cc1ccc(CC2(Cc3ccc(C=C)cc3)c3ccccc3-c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)cc4)cc32)cc1
InChIInChI=1S/C59H45N/c1-3-42-21-25-44(26-22-42)40-59(41-45-27-23-43(4-2)24-28-45)56-19-11-10-18-54(56)55-38-33-50(39-57(55)59)48-31-36-52(37-32-48)60(58-20-12-16-49-15-8-9-17-53(49)58)51-34-29-47(30-35-51)46-13-6-5-7-14-46/h3-39H,1-2,40-41H2
InChIKeyYNBWFEFWFZFFAL-UHFFFAOYSA-N
XLogP15.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500768.02
LogP ≤ 515.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[(4-ethenylphenyl)methyl]-N-[4-[4-[4-[[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-N-naphthalen-1-yl-9-phenylfluoren-2-amine
CID 146516715
9-(4-ethenylphenyl)-N-[4-[4-[4-[[9-(4-ethenylphenyl)-9-phenylfluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-N-naphthalen-1-yl-9-phenylfluoren-2-amine
CID 170070824
4-[4-[(9,9-dibenzylfluoren-2-yl)-naphthalen-1-ylamino]phenyl]benzoic acid
CID 139978857
9-(2,4-dimethylphenyl)-N-[4-[4-[4-[[9-(2,4-dimethylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
CID 146516604
9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
CID 146516645
N-[4-(4-heptacyclo[11.10.1.11,8.02,7.017,24.018,23.012,25]pentacosa-2(7),3,5,8,10,12(25),13,15,17(24),18,20,22-dodecaenyl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 156664766
7-carbazol-9-yl-N-(9,9-dimethylfluoren-2-yl)-9,9-bis[(4-ethenylphenyl)methyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 144690352
2-N,7-N-bis(4-ethenylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;4-ethenyl-N-[4-[4-(N-(4-ethenylphenyl)anilino)phenyl]phenyl]-N-phenylaniline;N-[4-[4-(4-ethenyl-N-(3-methylphenyl)anilino)phenyl]phenyl]-3-methyl-N-phenylaniline;N-[4-[4-(4-ethenyl-N-naphthalen-1-ylanilino)phenyl]phenyl]-N-(4-ethenylphenyl)naphthalen-1-amine
CID 159874682
2-N,2-N'-bis[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-2-N,2-N'-dinaphthalen-1-yl-9,9'-spirobi[fluorene]-2,2'-diamine;9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]naphthalen-1-yl]naphthalen-1-yl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine;9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
CID 161297701
9,9-dimethyl-N-naphthalen-1-yl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 118245872
N-[4-[4-[(4-ethenylphenyl)methoxy]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 59306565
N-phenyl-N-(4-spiro[benzo[b]fluorene-11,9'-fluorene]-2'-ylphenyl)naphthalen-1-amine
CID 134215984

Frequently Asked Questions

What is the IUPAC name of N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The IUPAC name of N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine (CID 166977720) is N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine is C=Cc1ccc(CC2(Cc3ccc(C=C)cc3)c3ccccc3-c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)cc4)cc32)cc1.
What is the InChIKey of N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The InChIKey is YNBWFEFWFZFFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H45N/c1-3-42-21-25-44(26-22-42)40-59(41-45-27-23-43(4-2)24-28-45)56-19-11-10-18-54(56)55-38-33-50(39-57(55)59)48-31-36-52(37-32-48)60(58-20-12-16-49-15-8-9-17-53(49)58)51-34-29-47(30-35-51)46-13-6-5-7-14-46/h3-39H,1-2,40-41H2.
What are the key properties of N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine has a molecular weight of 768.02 g/mol, XLogP of 15.68, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 166977720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).