N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine

C56H50FN — CID 145345975

IUPACN-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine
SMILESCC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(F)cc4)cc3)ccc2C2C=CC(c3ccc(C45CC6CC7CC(C4)C7(C6)C5)cc3)=CC21
InChIInChI=1S/C56H50FN/c1-54(2)52-29-42(41-8-17-43(18-9-41)55-32-36-28-44-30-45(34-55)56(44,33-36)35-55)16-26-50(52)51-27-25-49(31-53(51)54)58(47-21-12-39(13-22-47)37-6-4-3-5-7-37)48-23-14-40(15-24-48)38-10-19-46(57)20-11-38/h3-27,29,31,36,44-45,50,52H,28,30,32-35H2,1-2H3
InChIKeyUNCGKVFOZTVCFG-UHFFFAOYSA-N
MW756.02 g/mol
LogP14.74
Rot. Bonds7

About N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine

N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine (PubChem CID 145345975) has the molecular formula C56H50FN and a molecular weight of 756.02 g/mol. Its IUPAC name is N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine.

Molecular Properties

Compound NameN-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine
PubChem CID145345975
Molecular FormulaC56H50FN
Molecular Weight756.02 g/mol
Exact Mass755.39
IUPAC NameN-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine
SMILESCC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(F)cc4)cc3)ccc2C2C=CC(c3ccc(C45CC6CC7CC(C4)C7(C6)C5)cc3)=CC21
InChIInChI=1S/C56H50FN/c1-54(2)52-29-42(41-8-17-43(18-9-41)55-32-36-28-44-30-45(34-55)56(44,33-36)35-55)16-26-50(52)51-27-25-49(31-53(51)54)58(47-21-12-39(13-22-47)37-6-4-3-5-7-37)48-23-14-40(15-24-48)38-10-19-46(57)20-11-38/h3-27,29,31,36,44-45,50,52H,28,30,32-35H2,1-2H3
InChIKeyUNCGKVFOZTVCFG-UHFFFAOYSA-N
XLogP14.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500756.02
LogP ≤ 514.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine with MolForge

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Related Compounds

N-[4-(9,9-dimethyl-4a,9a-dihydrofluoren-2-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)-4-phenylaniline
CID 157466743
9,9-dimethyl-N-(4-methylphenyl)-N-(4-phenylphenyl)-4b,8a-dihydrofluoren-2-amine
CID 145141242
2-N-[4-(1-adamantyl)phenyl]-9,9-dimethyl-7-N,7-N-diphenyl-2-N-(4-phenylphenyl)fluorene-2,7-diamine
CID 164768061
9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine
CID 145345952
N,N-diphenyl-4-[4-(N-[4-(1-tetracyclo[5.2.1.03,8.05,8]decanyl)phenyl]anilino)phenyl]aniline
CID 155421599
N-(9,9-dimethyl-4b,8a-dihydrofluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 166820061
3-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-N-[4-(1-tricyclo[3.3.1.03,7]nonanyl)phenyl]aniline
CID 155421593
N-[4-[4-[4-(1-adamantyl)phenyl]phenyl]phenyl]-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine
CID 130203842
9,9-dimethyl-N-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]fluoren-2-amine
CID 155421798
N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 155220894
9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]-N-(4-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylphenyl)fluoren-2-amine
CID 156568185
9,9-dimethyl-N-phenyl-N-[4-[2-[4-(N-(4-phenylphenyl)anilino)phenyl]-2-adamantyl]phenyl]fluoren-2-amine
CID 168744555

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine?
The IUPAC name of N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine (CID 145345975) is N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine.
What is the SMILES notation for N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine?
The canonical SMILES for N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine is CC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(F)cc4)cc3)ccc2C2C=CC(c3ccc(C45CC6CC7CC(C4)C7(C6)C5)cc3)=CC21.
What is the InChIKey of N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine?
The InChIKey is UNCGKVFOZTVCFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H50FN/c1-54(2)52-29-42(41-8-17-43(18-9-41)55-32-36-28-44-30-45(34-55)56(44,33-36)35-55)16-26-50(52)51-27-25-49(31-53(51)54)58(47-21-12-39(13-22-47)37-6-4-3-5-7-37)48-23-14-40(15-24-48)38-10-19-46(57)20-11-38/h3-27,29,31,36,44-45,50,52H,28,30,32-35H2,1-2H3.
What are the key properties of N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine?
N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine has a molecular weight of 756.02 g/mol, XLogP of 14.74, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-7-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]-4b,8a-dihydrofluoren-2-amine is sourced from PubChem (CID 145345975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).