9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine

C50H37N — CID 145384499

IUPAC9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine
SMILESc1ccc(CC2(c3ccccc3)c3cc(-c4ccc(-c5ccccc5)cc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1
InChIInChI=1S/C50H37N/c1-6-16-37(17-7-1)36-50(42-20-10-3-11-21-42)48-34-41(40-28-26-39(27-29-40)38-18-8-2-9-19-38)30-32-46(48)47-33-31-45(35-49(47)50)51(43-22-12-4-13-23-43)44-24-14-5-15-25-44/h1-35H,36H2
InChIKeyXNAWRAVACMQFTM-UHFFFAOYSA-N
MW651.85 g/mol
LogP13.05
Rot. Bonds8

About 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine

9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine (PubChem CID 145384499) has the molecular formula C50H37N and a molecular weight of 651.85 g/mol. Its IUPAC name is 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine
PubChem CID145384499
Molecular FormulaC50H37N
Molecular Weight651.85 g/mol
Exact Mass651.29
IUPAC Name9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine
SMILESc1ccc(CC2(c3ccccc3)c3cc(-c4ccc(-c5ccccc5)cc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1
InChIInChI=1S/C50H37N/c1-6-16-37(17-7-1)36-50(42-20-10-3-11-21-42)48-34-41(40-28-26-39(27-29-40)38-18-8-2-9-19-38)30-32-46(48)47-33-31-45(35-49(47)50)51(43-22-12-4-13-23-43)44-24-14-5-15-25-44/h1-35H,36H2
InChIKeyXNAWRAVACMQFTM-UHFFFAOYSA-N
XLogP13.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500651.85
LogP ≤ 513.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-[7-[9,9-diphenyl-7-(N-phenylanilino)fluoren-2-yl]-9,9-diphenylfluoren-2-yl]-N,N,9,9-tetraphenylfluoren-2-amine
CID 101429725
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
9-(4-methylphenyl)-9-phenyl-N-(3-phenylphenyl)-N,7-bis(4-phenylphenyl)fluoren-2-amine
CID 90277842
9,9-dimethyl-7-(4-phenylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 118428445
N,4-diphenyl-N-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]aniline
CID 122452266
9,9-dimethyl-7-phenyl-N-(3-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 131994094
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
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
1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[2'-(N-(4-phenylphenyl)anilino)-9,9'-spirobi[fluorene]-2-yl]benzene-1,3-diamine
CID 121361274
N-phenyl-N-(4-phenylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-amine
CID 155079035
9-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienylsulfanyl)phenyl]-N-[4-[4-(N-[9-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienylsulfanyl)phenyl]-7,9-diphenylfluoren-2-yl]anilino)phenyl]phenyl]-N,7,9-triphenylfluoren-2-amine
CID 146516771
2-N,2-N,7-N,7-N-tetrakis(9,9-dimethyl-7-phenylfluoren-2-yl)-9,9-dimethylfluorene-2,7-diamine
CID 20759573

Frequently Asked Questions

What is the IUPAC name of 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine (CID 145384499) is 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine is c1ccc(CC2(c3ccccc3)c3cc(-c4ccc(-c5ccccc5)cc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.
What is the InChIKey of 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is XNAWRAVACMQFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H37N/c1-6-16-37(17-7-1)36-50(42-20-10-3-11-21-42)48-34-41(40-28-26-39(27-29-40)38-18-8-2-9-19-38)30-32-46(48)47-33-31-45(35-49(47)50)51(43-22-12-4-13-23-43)44-24-14-5-15-25-44/h1-35H,36H2.
What are the key properties of 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine?
9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 651.85 g/mol, XLogP of 13.05, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-benzyl-N,N,9-triphenyl-7-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 145384499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).