9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine

C49H35N — CID 90277808

IUPAC9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C49H35N/c1-5-16-36(17-6-1)38-28-32-42(33-29-38)50(43-34-30-39(31-35-43)37-18-7-2-8-19-37)47-27-15-25-45-44-24-13-14-26-46(44)49(48(45)47,40-20-9-3-10-21-40)41-22-11-4-12-23-41/h1-35H
InChIKeyNPMXHFDLFOPYEX-UHFFFAOYSA-N
MW637.83 g/mol
LogP12.85
Rot. Bonds7

About 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine

9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine (PubChem CID 90277808) has the molecular formula C49H35N and a molecular weight of 637.83 g/mol. Its IUPAC name is 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine.

Molecular Properties

Compound Name9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine
PubChem CID90277808
Molecular FormulaC49H35N
Molecular Weight637.83 g/mol
Exact Mass637.28
IUPAC Name9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C49H35N/c1-5-16-36(17-6-1)38-28-32-42(33-29-38)50(43-34-30-39(31-35-43)37-18-7-2-8-19-37)47-27-15-25-45-44-24-13-14-26-46(44)49(48(45)47,40-20-9-3-10-21-40)41-22-11-4-12-23-41/h1-35H
InChIKeyNPMXHFDLFOPYEX-UHFFFAOYSA-N
XLogP12.85
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500637.83
LogP ≤ 512.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(3,5-diphenylphenyl)phenyl]-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-1-amine
CID 121381614
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[3-(3-phenylphenyl)phenyl]fluoren-1-amine;9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[3-(4-phenylphenyl)phenyl]fluoren-1-amine;9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]fluoren-1-amine
CID 161362577
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[2-(3-phenylphenyl)phenyl]fluoren-1-amine
CID 121381740
3-N-(9,9-diphenylfluoren-3-yl)-1-N,1-N-diphenyl-3-N-[3-(9-phenylfluoren-9-yl)phenyl]benzene-1,3-diamine;3-N-(9,9-diphenylfluoren-1-yl)-3-N-[3-(9-phenylfluoren-9-yl)phenyl]-1-N-(3-phenylphenyl)-1-N-(4-phenylphenyl)benzene-1,3-diamine
CID 161236726
9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]fluoren-1-amine
CID 167260563
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 121464380
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
CID 121285751
N-[4-(4-phenylphenyl)phenyl]-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-1-amine
CID 130308420
CID 134451141
CID 134451141
N-[4-(4-tert-butylphenyl)phenyl]-9-(4-methylphenyl)-N-[9-(4-methylphenyl)-9-(4-phenylphenyl)fluoren-2-yl]-9-phenylfluoren-1-amine
CID 177066968
2',7'-dimethyl-N,N-bis(4-phenylphenyl)-9,9'-spirobi[fluorene]-1-amine
CID 146541622
N-[4-[4-[4-[4-[(9,9-dimethylfluoren-2-yl)-(9,9'-spirobi[fluorene]-1-yl)amino]phenyl]phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-1-amine
CID 155005492

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine?
The IUPAC name of 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine (CID 90277808) is 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine.
What is the SMILES notation for 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine?
The canonical SMILES for 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.
What is the InChIKey of 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine?
The InChIKey is NPMXHFDLFOPYEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H35N/c1-5-16-36(17-6-1)38-28-32-42(33-29-38)50(43-34-30-39(31-35-43)37-18-7-2-8-19-37)47-27-15-25-45-44-24-13-14-26-46(44)49(48(45)47,40-20-9-3-10-21-40)41-22-11-4-12-23-41/h1-35H.
What are the key properties of 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine?
9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine has a molecular weight of 637.83 g/mol, XLogP of 12.85, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-1-amine is sourced from PubChem (CID 90277808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).