N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine

C70H59N — CID 169030027

IUPACN-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESCC1(C)CCC(C)(C)c2cc3c(cc21)-c1c(-c2ccc4cc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)ccc4c2)cccc1C3(C)C
InChIInChI=1S/C70H59N/c1-67(2)39-40-68(3,4)65-45-62-59(44-64(65)67)66-56(26-18-28-61(66)69(62,5)6)50-30-29-49-42-54(36-33-48(49)41-50)71(53-34-31-47(32-35-53)46-19-10-7-11-20-46)55-37-38-58-57-25-16-17-27-60(57)70(63(58)43-55,51-21-12-8-13-22-51)52-23-14-9-15-24-52/h7-38,41-45H,39-40H2,1-6H3
InChIKeySKTXFXRFNAZTFU-UHFFFAOYSA-N
MW914.25 g/mol
LogP18.66
Rot. Bonds7

About N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine

N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 169030027) has the molecular formula C70H59N and a molecular weight of 914.25 g/mol. Its IUPAC name is N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID169030027
Molecular FormulaC70H59N
Molecular Weight914.25 g/mol
Exact Mass913.46
IUPAC NameN-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESCC1(C)CCC(C)(C)c2cc3c(cc21)-c1c(-c2ccc4cc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)ccc4c2)cccc1C3(C)C
InChIInChI=1S/C70H59N/c1-67(2)39-40-68(3,4)65-45-62-59(44-64(65)67)66-56(26-18-28-61(66)69(62,5)6)50-30-29-49-42-54(36-33-48(49)41-50)71(53-34-31-47(32-35-53)46-19-10-7-11-20-46)55-37-38-58-57-25-16-17-27-60(57)70(63(58)43-55,51-21-12-8-13-22-51)52-23-14-9-15-24-52/h7-38,41-45H,39-40H2,1-6H3
InChIKeySKTXFXRFNAZTFU-UHFFFAOYSA-N
XLogP18.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500914.25
LogP ≤ 518.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine with MolForge

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Related Compounds

9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(6,6,9,9-tetramethyl-11,11-diphenyl-7,8-dihydrobenzo[b]fluoren-4-yl)phenyl]fluoren-4-amine
CID 169029920
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenylfluoren-2-amine
CID 166565951
N,9,9-triphenyl-N-[4-[4-(N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)anilino)phenyl]phenyl]fluoren-2-amine
CID 171735958
9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylphenyl)fluoren-2-amine;N-(3,4-diphenylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[3-phenyl-4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 159227060
N-(9,9-diphenylfluoren-2-yl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[b]fluoren-2-amine
CID 138601435
9,9-dimethyl-N-(4-phenylphenyl)-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]fluoren-2-amine
CID 163787902
N-(3,4-diphenylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(3,4-diphenylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160568541
N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine
CID 170448050
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 118298338
6,6,12,12-tetramethyl-N,10-diphenyl-N-[4-(4-phenylphenyl)phenyl]indeno[1,2-b]fluoren-2-amine
CID 138455850
N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-amine
CID 118298327
N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-7-naphthalen-2-yl-N-(4-phenylphenyl)fluoren-2-amine
CID 126548455

Frequently Asked Questions

What is the IUPAC name of N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine (CID 169030027) is N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine is CC1(C)CCC(C)(C)c2cc3c(cc21)-c1c(-c2ccc4cc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)ccc4c2)cccc1C3(C)C.
What is the InChIKey of N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is SKTXFXRFNAZTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H59N/c1-67(2)39-40-68(3,4)65-45-62-59(44-64(65)67)66-56(26-18-28-61(66)69(62,5)6)50-30-29-49-42-54(36-33-48(49)41-50)71(53-34-31-47(32-35-53)46-19-10-7-11-20-46)55-37-38-58-57-25-16-17-27-60(57)70(63(58)43-55,51-21-12-8-13-22-51)52-23-14-9-15-24-52/h7-38,41-45H,39-40H2,1-6H3.
What are the key properties of N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine?
N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 914.25 g/mol, XLogP of 18.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(6,6,9,9,11,11-hexamethyl-7,8-dihydrobenzo[b]fluoren-4-yl)naphthalen-2-yl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 169030027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).