N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine

C78H70N2 — CID 146434387

IUPACN-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
SMILESCC1(C)CC(C)(c2cccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2)c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21
InChIInChI=1S/C78H70N2/c1-73(2)47-78(11,48-21-20-22-49(41-48)79(50-31-36-59-55-23-12-16-27-63(55)74(3,4)68(59)42-50)51-32-37-60-56-24-13-17-28-64(56)75(5,6)69(60)43-51)67-40-35-54(46-72(67)73)80(52-33-38-61-57-25-14-18-29-65(57)76(7,8)70(61)44-52)53-34-39-62-58-26-15-19-30-66(58)77(9,10)71(62)45-53/h12-46H,47H2,1-11H3
InChIKeyKOCBANPUPYFZEI-UHFFFAOYSA-N
MW1035.43 g/mol
LogP20.84
Rot. Bonds7

About N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine

N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (PubChem CID 146434387) has the molecular formula C78H70N2 and a molecular weight of 1035.43 g/mol. Its IUPAC name is N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
PubChem CID146434387
Molecular FormulaC78H70N2
Molecular Weight1035.43 g/mol
Exact Mass1034.55
IUPAC NameN-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
SMILESCC1(C)CC(C)(c2cccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2)c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21
InChIInChI=1S/C78H70N2/c1-73(2)47-78(11,48-21-20-22-49(41-48)79(50-31-36-59-55-23-12-16-27-63(55)74(3,4)68(59)42-50)51-32-37-60-56-24-13-17-28-64(56)75(5,6)69(60)43-51)67-40-35-54(46-72(67)73)80(52-33-38-61-57-25-14-18-29-65(57)76(7,8)70(61)44-52)53-34-39-62-58-26-15-19-30-66(58)77(9,10)71(62)45-53/h12-46H,47H2,1-11H3
InChIKeyKOCBANPUPYFZEI-UHFFFAOYSA-N
XLogP20.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms80
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001035.43
LogP ≤ 520.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine
CID 158817105
N-(4-methoxy-3-phenylphenyl)-N-[1-[3-[4-methoxy-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-9,9'-spirobi[fluorene]-2-amine
CID 146434390
N-[3-[7-[bis(9,9-diphenylfluoren-2-yl)amino]-1,3,3-trimethyl-2H-inden-1-yl]phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[3-[7-[(9,9-diphenylfluoren-2-yl)-(9,9'-spirobi[fluorene]-2-yl)amino]-1,3,3-trimethyl-2H-inden-1-yl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 158218287
N-[4-[2-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 121298487
9,9-dimethyl-N-[3-(9-phenylfluoren-9-yl)phenyl]-N-(3-phenylphenyl)fluoren-2-amine
CID 139384269
4-N-(9,9-dimethylfluoren-2-yl)-1-N,1-N-diphenyl-4-N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine
CID 59025126
N-[4-[2,5-diphenyl-4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 176611399
N,N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-5-phenylfluoren-3-amine
CID 169039545
bis(N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine);N-(9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine
CID 161294273
6-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]-N,N,6-triphenylbenzo[c]chromen-3-amine
CID 167340414
N-(9,9-dimethylfluoren-2-yl)-7,9,9-trimethyl-N-(7,9,9-trimethylfluoren-2-yl)fluoren-2-amine
CID 151367226
9,9-dimethyl-N,N-bis(4-methylphenyl)fluoren-2-amine
CID 11111910

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (CID 146434387) is N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine is CC1(C)CC(C)(c2cccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2)c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.
What is the InChIKey of N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The InChIKey is KOCBANPUPYFZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H70N2/c1-73(2)47-78(11,48-21-20-22-49(41-48)79(50-31-36-59-55-23-12-16-27-63(55)74(3,4)68(59)42-50)51-32-37-60-56-24-13-17-28-64(56)75(5,6)69(60)43-51)67-40-35-54(46-72(67)73)80(52-33-38-61-57-25-14-18-29-65(57)76(7,8)70(61)44-52)53-34-39-62-58-26-15-19-30-66(58)77(9,10)71(62)45-53/h12-46H,47H2,1-11H3.
What are the key properties of N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine has a molecular weight of 1035.43 g/mol, XLogP of 20.84, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 146434387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).