9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine

C71H67N — CID 170448043

IUPAC9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine
SMILESCC1(C)CCC(C)(C)c2cc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cc4c(cc3-c3cccc5c3C(C)(C)CCC5(C)C)-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc21
InChIInChI=1S/C71H67N/c1-67(2)41-42-69(5,6)64-45-55(39-40-61(64)67)72(54-37-35-51(36-38-54)50-33-31-49(32-34-50)48-21-12-9-13-22-48)65-47-63-58(46-59(65)57-28-20-30-62-66(57)70(7,8)44-43-68(62,3)4)56-27-18-19-29-60(56)71(63,52-23-14-10-15-24-52)53-25-16-11-17-26-53/h9-40,45-47H,41-44H2,1-8H3
InChIKeyWTPOQHCLHPXXHN-UHFFFAOYSA-N
MW934.32 g/mol
LogP19.22
Rot. Bonds8

About 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine

9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine (PubChem CID 170448043) has the molecular formula C71H67N and a molecular weight of 934.32 g/mol. Its IUPAC name is 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine.

Molecular Properties

Compound Name9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine
PubChem CID170448043
Molecular FormulaC71H67N
Molecular Weight934.32 g/mol
Exact Mass933.53
IUPAC Name9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine
SMILESCC1(C)CCC(C)(C)c2cc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cc4c(cc3-c3cccc5c3C(C)(C)CCC5(C)C)-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc21
InChIInChI=1S/C71H67N/c1-67(2)41-42-69(5,6)64-45-55(39-40-61(64)67)72(54-37-35-51(36-38-54)50-33-31-49(32-34-50)48-21-12-9-13-22-48)65-47-63-58(46-59(65)57-28-20-30-62-66(57)70(7,8)44-43-68(62,3)4)56-27-18-19-29-60(56)71(63,52-23-14-10-15-24-52)53-25-16-11-17-26-53/h9-40,45-47H,41-44H2,1-8H3
InChIKeyWTPOQHCLHPXXHN-UHFFFAOYSA-N
XLogP19.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms72
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500934.32
LogP ≤ 519.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?
The IUPAC name of 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine (CID 170448043) is 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine.
What is the SMILES notation for 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?
The canonical SMILES for 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine is CC1(C)CCC(C)(C)c2cc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cc4c(cc3-c3cccc5c3C(C)(C)CCC5(C)C)-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc21.
What is the InChIKey of 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?
The InChIKey is WTPOQHCLHPXXHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H67N/c1-67(2)41-42-69(5,6)64-45-55(39-40-61(64)67)72(54-37-35-51(36-38-54)50-33-31-49(32-34-50)48-21-12-9-13-22-48)65-47-63-58(46-59(65)57-28-20-30-62-66(57)70(7,8)44-43-68(62,3)4)56-27-18-19-29-60(56)71(63,52-23-14-10-15-24-52)53-25-16-11-17-26-53/h9-40,45-47H,41-44H2,1-8H3.
What are the key properties of 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?
9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine has a molecular weight of 934.32 g/mol, XLogP of 19.22, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine is sourced from PubChem (CID 170448043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).