N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine

C63H55N — CID 167285862

IUPACN-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine
SMILESCC(C)c1cc2c(c(C(C)C)c1)C(C)(C)c1cc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccccc4-c4ccccc4)c3-c3ccccc3-c3ccccc3)ccc1-2
InChIInChI=1S/C63H55N/c1-42(2)48-39-57(43(3)4)62-58(40-48)54-38-37-50(41-59(54)63(62,5)6)64(49-35-33-45(34-36-49)44-21-10-7-11-22-44)60-32-20-31-56(53-29-18-16-27-51(53)46-23-12-8-13-24-46)61(60)55-30-19-17-28-52(55)47-25-14-9-15-26-47/h7-43H,1-6H3
InChIKeyFOXIXZCYNRMIAR-UHFFFAOYSA-N
MW826.14 g/mol
LogP18.04
Rot. Bonds10

About N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine

N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine (PubChem CID 167285862) has the molecular formula C63H55N and a molecular weight of 826.14 g/mol. Its IUPAC name is N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine.

Molecular Properties

Compound NameN-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine
PubChem CID167285862
Molecular FormulaC63H55N
Molecular Weight826.14 g/mol
Exact Mass825.43
IUPAC NameN-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine
SMILESCC(C)c1cc2c(c(C(C)C)c1)C(C)(C)c1cc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccccc4-c4ccccc4)c3-c3ccccc3-c3ccccc3)ccc1-2
InChIInChI=1S/C63H55N/c1-42(2)48-39-57(43(3)4)62-58(40-48)54-38-37-50(41-59(54)63(62,5)6)64(49-35-33-45(34-36-49)44-21-10-7-11-22-44)60-32-20-31-56(53-29-18-16-27-51(53)46-23-12-8-13-24-46)61(60)55-30-19-17-28-52(55)47-25-14-9-15-26-47/h7-43H,1-6H3
InChIKeyFOXIXZCYNRMIAR-UHFFFAOYSA-N
XLogP18.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500826.14
LogP ≤ 518.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine with MolForge

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Related Compounds

9,9-dimethyl-8-phenyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 167285414
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 167285492
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 168788568
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-3-phenyl-2-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 168788736
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[3-(2-phenylphenyl)-2-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 167285846
9,9-dimethyl-N-[3-(2-phenylphenyl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 167285489
N-[4-[2-(9,9-dimethylfluoren-1-yl)phenyl]phenyl]-9,9-dimethyl-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 170218178
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)tetracyclo[8.6.0.03,8.011,16]hexadeca-1,3,5,7,9,11(16),12,14-octaen-12-amine
CID 166031628
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 167285595
7-cyclohexyl-9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 167285409
N-[3-(9,9-dimethylfluoren-2-yl)-2-(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-4-amine
CID 167285886
N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 168791038

Frequently Asked Questions

What is the IUPAC name of N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine?
The IUPAC name of N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine (CID 167285862) is N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine.
What is the SMILES notation for N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine?
The canonical SMILES for N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine is CC(C)c1cc2c(c(C(C)C)c1)C(C)(C)c1cc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccccc4-c4ccccc4)c3-c3ccccc3-c3ccccc3)ccc1-2.
What is the InChIKey of N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine?
The InChIKey is FOXIXZCYNRMIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H55N/c1-42(2)48-39-57(43(3)4)62-58(40-48)54-38-37-50(41-59(54)63(62,5)6)64(49-35-33-45(34-36-49)44-21-10-7-11-22-44)60-32-20-31-56(53-29-18-16-27-51(53)46-23-12-8-13-24-46)61(60)55-30-19-17-28-52(55)47-25-14-9-15-26-47/h7-43H,1-6H3.
What are the key properties of N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine?
N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine has a molecular weight of 826.14 g/mol, XLogP of 18.04, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3-bis(2-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,8-di(propan-2-yl)fluoren-2-amine is sourced from PubChem (CID 167285862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).