N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine

C70H55N — CID 171401761

IUPACN,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c4c(cc5c3-c3ccccc3C5(c3ccccc3)c3ccccc3)C(C)(C)c3ccc(-c5ccccc5)cc3-4)cc21
InChIInChI=1S/C70H55N/c1-67(2)56-31-19-16-28-50(56)52-37-35-48(41-60(52)67)71(49-36-38-53-51-29-17-20-32-57(51)68(3,4)61(53)42-49)66-64-54-30-18-21-33-59(54)70(46-24-12-8-13-25-46,47-26-14-9-15-27-47)63(64)43-62-65(66)55-40-45(44-22-10-7-11-23-44)34-39-58(55)69(62,5)6/h7-43H,1-6H3
InChIKeyUPFOEULLQZCLOH-UHFFFAOYSA-N
MW910.22 g/mol
LogP18.11
Rot. Bonds6

About N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine

N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine (PubChem CID 171401761) has the molecular formula C70H55N and a molecular weight of 910.22 g/mol. Its IUPAC name is N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine.

Molecular Properties

Compound NameN,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine
PubChem CID171401761
Molecular FormulaC70H55N
Molecular Weight910.22 g/mol
Exact Mass909.43
IUPAC NameN,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c4c(cc5c3-c3ccccc3C5(c3ccccc3)c3ccccc3)C(C)(C)c3ccc(-c5ccccc5)cc3-4)cc21
InChIInChI=1S/C70H55N/c1-67(2)56-31-19-16-28-50(56)52-37-35-48(41-60(52)67)71(49-36-38-53-51-29-17-20-32-57(51)68(3,4)61(53)42-49)66-64-54-30-18-21-33-59(54)70(46-24-12-8-13-25-46,47-26-14-9-15-27-47)63(64)43-62-65(66)55-40-45(44-22-10-7-11-23-44)34-39-58(55)69(62,5)6/h7-43H,1-6H3
InChIKeyUPFOEULLQZCLOH-UHFFFAOYSA-N
XLogP18.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500910.22
LogP ≤ 518.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine with MolForge

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-12,12-dimethyl-N,7,10,10-tetraphenylindeno[2,1-b]fluoren-5-amine
CID 171401927
N-(9,9-dimethylfluoren-2-yl)-10,10,12,12-tetramethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]indeno[2,1-b]fluoren-5-amine
CID 171401760
N-[4-(9,9-diphenylfluoren-3-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 126548554
N-[4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 142481064
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2,4,6-triphenylphenyl)fluoren-2-amine
CID 155181804
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 118298338
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-dimethylfluoren-2-yl)-12',12'-dimethyl-5'-phenyl-N-(4-phenylphenyl)spiro[fluorene-9,10'-indeno[2,1-b]fluorene]-7'-amine
CID 171402066
N,N-bis(9,9-dimethylfluoren-2-yl)-3,7,7-triphenylfluoreno[2,3-b][1]benzothiol-12-amine
CID 171402184
3-[4-[4-[N,4-bis(9,9-dimethylfluoren-2-yl)anilino]phenyl]phenyl]-N-[6-[7-[(9,9-diphenylfluoren-2-yl)-(9,9'-spirobi[fluorene]-2-yl)amino]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 139519919
9,9-dimethyl-N-(4-phenylphenyl)-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]fluoren-2-amine
CID 163787902
N-[4-(7,7-diphenylbenzo[c]fluoren-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 146364220

Frequently Asked Questions

What is the IUPAC name of N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine?
The IUPAC name of N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine (CID 171401761) is N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine.
What is the SMILES notation for N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine?
The canonical SMILES for N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c4c(cc5c3-c3ccccc3C5(c3ccccc3)c3ccccc3)C(C)(C)c3ccc(-c5ccccc5)cc3-4)cc21.
What is the InChIKey of N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine?
The InChIKey is UPFOEULLQZCLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H55N/c1-67(2)56-31-19-16-28-50(56)52-37-35-48(41-60(52)67)71(49-36-38-53-51-29-17-20-32-57(51)68(3,4)61(53)42-49)66-64-54-30-18-21-33-59(54)70(46-24-12-8-13-25-46,47-26-14-9-15-27-47)63(64)43-62-65(66)55-40-45(44-22-10-7-11-23-44)34-39-58(55)69(62,5)6/h7-43H,1-6H3.
What are the key properties of N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine?
N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine has a molecular weight of 910.22 g/mol, XLogP of 18.11, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7,12,12-triphenylindeno[2,1-b]fluoren-5-amine is sourced from PubChem (CID 171401761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).