9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine

C51H39N — CID 170529416

IUPAC9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESCC1(C)c2cccc(-c3ccccc3)c2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)c(-c3ccccc3)c21
InChIInChI=1S/C51H39N/c1-51(2)46-25-15-24-44(40-20-11-5-12-21-40)49(46)45-34-35-47(48(50(45)51)41-22-13-6-14-23-41)52(42-30-26-38(27-31-42)36-16-7-3-8-17-36)43-32-28-39(29-33-43)37-18-9-4-10-19-37/h3-35H,1-2H3
InChIKeyIRVFLWFOQLEVEB-UHFFFAOYSA-N
MW665.88 g/mol
LogP14.13
Rot. Bonds7

About 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine

9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine (PubChem CID 170529416) has the molecular formula C51H39N and a molecular weight of 665.88 g/mol. Its IUPAC name is 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
PubChem CID170529416
Molecular FormulaC51H39N
Molecular Weight665.88 g/mol
Exact Mass665.31
IUPAC Name9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESCC1(C)c2cccc(-c3ccccc3)c2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)c(-c3ccccc3)c21
InChIInChI=1S/C51H39N/c1-51(2)46-25-15-24-44(40-20-11-5-12-21-40)49(46)45-34-35-47(48(50(45)51)41-22-13-6-14-23-41)52(42-30-26-38(27-31-42)36-16-7-3-8-17-36)43-32-28-39(29-33-43)37-18-9-4-10-19-37/h3-35H,1-2H3
InChIKeyIRVFLWFOQLEVEB-UHFFFAOYSA-N
XLogP14.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500665.88
LogP ≤ 514.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9,9-dimethyl-5-phenyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 155153854
9,9-dimethyl-N-(1-phenylnaphthalen-2-yl)-N,5-bis(4-phenylphenyl)fluoren-2-amine
CID 170417648
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-4-amine
CID 168789453
9,9-dimethyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-4-amine
CID 90294553
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-N,4'-diphenyl-9,9'-spirobi[fluorene]-4-amine
CID 129258928
N-[3-(9,9-dimethylfluoren-4-yl)phenyl]-3-phenyl-2-(2-phenylphenyl)-N-(4-phenylphenyl)aniline
CID 168788466
N-[4-(9,9-dimethyl-5-phenylfluoren-3-yl)phenyl]-N,4-diphenylaniline
CID 169039821
N-[4-(1-bicyclo[2.2.1]heptanyl)phenyl]-N-(4-cyclohexylphenyl)-9,9-dimethyl-1,5-diphenylfluoren-2-amine
CID 168739064
9,9-dimethyl-5-phenyl-3-(3-phenylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine
CID 170529489
6,6,12,12-tetramethyl-N,10-diphenyl-N-[4-(4-phenylphenyl)phenyl]indeno[1,2-b]fluoren-2-amine
CID 138455850
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 167285492
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-3-phenyl-2-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 168788736

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine (CID 170529416) is 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine is CC1(C)c2cccc(-c3ccccc3)c2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)c(-c3ccccc3)c21.
What is the InChIKey of 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The InChIKey is IRVFLWFOQLEVEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H39N/c1-51(2)46-25-15-24-44(40-20-11-5-12-21-40)49(46)45-34-35-47(48(50(45)51)41-22-13-6-14-23-41)52(42-30-26-38(27-31-42)36-16-7-3-8-17-36)43-32-28-39(29-33-43)37-18-9-4-10-19-37/h3-35H,1-2H3.
What are the key properties of 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine has a molecular weight of 665.88 g/mol, XLogP of 14.13, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-1,5-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 170529416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).