9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine

C55H41N — CID 170417832

IUPAC9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine
SMILESCC1(C)c2cc(N(c3ccccc3)c3cccc(-c4cc5ccccc5cc4-c4ccc(-c5ccccc5)cc4)c3)ccc2-c2c(-c3ccccc3)cccc21
InChIInChI=1S/C55H41N/c1-55(2)52-27-15-26-48(40-18-8-4-9-19-40)54(52)49-33-32-47(37-53(49)55)56(45-23-10-5-11-24-45)46-25-14-22-44(34-46)51-36-43-21-13-12-20-42(43)35-50(51)41-30-28-39(29-31-41)38-16-6-3-7-17-38/h3-37H,1-2H3
InChIKeyAMMLCVOBQHPXPY-UHFFFAOYSA-N
MW715.94 g/mol
LogP15.28
Rot. Bonds7

About 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine

9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine (PubChem CID 170417832) has the molecular formula C55H41N and a molecular weight of 715.94 g/mol. Its IUPAC name is 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine
PubChem CID170417832
Molecular FormulaC55H41N
Molecular Weight715.94 g/mol
Exact Mass715.32
IUPAC Name9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine
SMILESCC1(C)c2cc(N(c3ccccc3)c3cccc(-c4cc5ccccc5cc4-c4ccc(-c5ccccc5)cc4)c3)ccc2-c2c(-c3ccccc3)cccc21
InChIInChI=1S/C55H41N/c1-55(2)52-27-15-26-48(40-18-8-4-9-19-40)54(52)49-33-32-47(37-53(49)55)56(45-23-10-5-11-24-45)46-25-14-22-44(34-46)51-36-43-21-13-12-20-42(43)35-50(51)41-30-28-39(29-31-41)38-16-6-3-7-17-38/h3-37H,1-2H3
InChIKeyAMMLCVOBQHPXPY-UHFFFAOYSA-N
XLogP15.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.94
LogP ≤ 515.28
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-[4-(3-naphthalen-1-ylnaphthalen-2-yl)phenyl]-N,5-diphenylfluoren-2-amine
CID 170417724
9,9-dimethyl-5-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylnaphthalen-2-yl)phenyl]fluoren-2-amine
CID 170417762
9,9-dimethyl-N-[4-(3-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 139352574
9,9-dimethyl-N,5-diphenyl-N-[3-(1-phenylnaphthalen-2-yl)phenyl]fluoren-2-amine
CID 170417792
N,N-bis(9,9-dimethyl-5-phenylfluoren-2-yl)-9,9-dimethyl-5-phenylfluoren-2-amine
CID 170179873
6,6,12,12-tetramethyl-N,10-diphenyl-N-[4-(4-phenylphenyl)phenyl]indeno[1,2-b]fluoren-2-amine
CID 138455850
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]naphthalen-2-amine
CID 169020198
3-(9,9-dimethylfluoren-4-yl)-N-[3-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 154972984
3-(9,9-dimethylfluoren-4-yl)-N-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 169019775
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-3-(4-phenylphenyl)aniline
CID 169019629
9,9-dimethyl-N-naphthalen-2-yl-5-phenyl-N-[4-(1-phenylnaphthalen-2-yl)phenyl]fluoren-2-amine
CID 170417688

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine (CID 170417832) is 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine is CC1(C)c2cc(N(c3ccccc3)c3cccc(-c4cc5ccccc5cc4-c4ccc(-c5ccccc5)cc4)c3)ccc2-c2c(-c3ccccc3)cccc21.
What is the InChIKey of 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine?
The InChIKey is AMMLCVOBQHPXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H41N/c1-55(2)52-27-15-26-48(40-18-8-4-9-19-40)54(52)49-33-32-47(37-53(49)55)56(45-23-10-5-11-24-45)46-25-14-22-44(34-46)51-36-43-21-13-12-20-42(43)35-50(51)41-30-28-39(29-31-41)38-16-6-3-7-17-38/h3-37H,1-2H3.
What are the key properties of 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine?
9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine has a molecular weight of 715.94 g/mol, XLogP of 15.28, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine is sourced from PubChem (CID 170417832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).