N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine

C55H41N — CID 170529480

IUPACN-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine
SMILESCC1(C)c2cc(-c3ccc(N(c4ccccc4-c4ccccc4)c4cccc5ccccc45)cc3)c(-c3ccccc3)cc2-c2c(-c3ccccc3)cccc21
InChIInChI=1S/C55H41N/c1-55(2)50-29-17-28-46(40-20-8-4-9-21-40)54(50)49-36-47(41-22-10-5-11-23-41)48(37-51(49)55)42-32-34-43(35-33-42)56(53-31-16-25-39-24-12-13-26-45(39)53)52-30-15-14-27-44(52)38-18-6-3-7-19-38/h3-37H,1-2H3
InChIKeyHDFNOXYKDCKGBH-UHFFFAOYSA-N
MW715.94 g/mol
LogP15.28
Rot. Bonds7

About N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine

N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine (PubChem CID 170529480) has the molecular formula C55H41N and a molecular weight of 715.94 g/mol. Its IUPAC name is N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine
PubChem CID170529480
Molecular FormulaC55H41N
Molecular Weight715.94 g/mol
Exact Mass715.32
IUPAC NameN-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine
SMILESCC1(C)c2cc(-c3ccc(N(c4ccccc4-c4ccccc4)c4cccc5ccccc45)cc3)c(-c3ccccc3)cc2-c2c(-c3ccccc3)cccc21
InChIInChI=1S/C55H41N/c1-55(2)50-29-17-28-46(40-20-8-4-9-21-40)54(50)49-36-47(41-22-10-5-11-23-41)48(37-51(49)55)42-32-34-43(35-33-42)56(53-31-16-25-39-24-12-13-26-45(39)53)52-30-15-14-27-44(52)38-18-6-3-7-19-38/h3-37H,1-2H3
InChIKeyHDFNOXYKDCKGBH-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

Analyze N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-5-phenyl-N-(2-phenylphenyl)fluoren-3-amine
CID 169039673
9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)-N,3,5-triphenylfluoren-2-amine
CID 170529453
9,9-dimethyl-N-[4-[4-[4-(N-naphthalen-1-ylanilino)phenyl]-2,5-diphenylphenyl]phenyl]-N-phenylfluoren-2-amine
CID 176611486
9,9-dimethyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169020491
12,12,22,22-tetramethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(24),2(11),3,5,7,9,13,15(23),16(21),17,19-undecaen-17-amine
CID 155095526
9,9-dimethyl-N-naphthalen-1-yl-N-naphthalen-2-yl-5-phenylfluoren-3-amine
CID 169039849
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]naphthalen-1-amine
CID 169019753
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]naphthalen-1-amine
CID 168790736
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170303519
N-(9,9-dimethyl-5-phenylfluoren-3-yl)-N-naphthalen-1-ylphenanthren-2-amine
CID 169039825
9,9-dimethyl-N-[2-(3-naphthalen-1-ylnaphthalen-2-yl)phenyl]-N,5-diphenylfluoren-2-amine
CID 170417859
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)-2,4-diphenylaniline
CID 170134747

Frequently Asked Questions

What is the IUPAC name of N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine?
The IUPAC name of N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine (CID 170529480) is N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine is CC1(C)c2cc(-c3ccc(N(c4ccccc4-c4ccccc4)c4cccc5ccccc45)cc3)c(-c3ccccc3)cc2-c2c(-c3ccccc3)cccc21.
What is the InChIKey of N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine?
The InChIKey is HDFNOXYKDCKGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H41N/c1-55(2)50-29-17-28-46(40-20-8-4-9-21-40)54(50)49-36-47(41-22-10-5-11-23-41)48(37-51(49)55)42-32-34-43(35-33-42)56(53-31-16-25-39-24-12-13-26-45(39)53)52-30-15-14-27-44(52)38-18-6-3-7-19-38/h3-37H,1-2H3.
What are the key properties of N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine?
N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-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 N-[4-(9,9-dimethyl-3,5-diphenylfluoren-2-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 170529480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).