N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene

C106H79BrN2 — CID 158405780

IUPACN-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene
SMILESC=Cc1c2ccccc2c(-c2cccc3ccccc23)c2ccccc12.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(/C=C/c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(Br)cc3)cc21
InChIInChI=1S/C53H39N.C27H22BrN.C26H18/c1-53(2)50-26-13-12-22-45(50)46-34-32-40(35-51(46)53)54(38-17-4-3-5-18-38)39-30-27-36(28-31-39)29-33-44-42-20-8-10-23-48(42)52(49-24-11-9-21-43(44)49)47-25-14-16-37-15-6-7-19-41(37)47;1-27(2)25-11-7-6-10-23(25)24-17-16-22(18-26(24)27)29(20-8-4-3-5-9-20)21-14-12-19(28)13-15-21;1-2-19-21-13-5-7-15-24(21)26(25-16-8-6-14-22(19)25)23-17-9-11-18-10-3-4-12-20(18)23/h3-35H,1-2H3;3-18H,1-2H3;2-17H,1H2/b33-29+;;
InChIKeyGYRDIAATYLBFCD-HSQUEQGVSA-N
MW1460.72 g/mol
LogP30.44
Rot. Bonds11

About N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene

N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene (PubChem CID 158405780) has the molecular formula C106H79BrN2 and a molecular weight of 1460.72 g/mol. Its IUPAC name is N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene.

Molecular Properties

Compound NameN-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene
PubChem CID158405780
Molecular FormulaC106H79BrN2
Molecular Weight1460.72 g/mol
Exact Mass1458.54
IUPAC NameN-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene
SMILESC=Cc1c2ccccc2c(-c2cccc3ccccc23)c2ccccc12.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(/C=C/c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(Br)cc3)cc21
InChIInChI=1S/C53H39N.C27H22BrN.C26H18/c1-53(2)50-26-13-12-22-45(50)46-34-32-40(35-51(46)53)54(38-17-4-3-5-18-38)39-30-27-36(28-31-39)29-33-44-42-20-8-10-23-48(42)52(49-24-11-9-21-43(44)49)47-25-14-16-37-15-6-7-19-41(37)47;1-27(2)25-11-7-6-10-23(25)24-17-16-22(18-26(24)27)29(20-8-4-3-5-9-20)21-14-12-19(28)13-15-21;1-2-19-21-13-5-7-15-24(21)26(25-16-8-6-14-22(19)25)23-17-9-11-18-10-3-4-12-20(18)23/h3-35H,1-2H3;3-18H,1-2H3;2-17H,1H2/b33-29+;;
InChIKeyGYRDIAATYLBFCD-HSQUEQGVSA-N
XLogP30.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms109
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001460.72
LogP ≤ 530.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene 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

9,9-dimethyl-N-naphthalen-1-yl-N-[4-[4-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]phenyl]fluoren-2-amine
CID 89067766
4-[(E)-2-[10-(7,7-dimethylbenzo[c]fluoren-5-yl)anthracen-9-yl]ethenyl]-N,N-diphenylaniline
CID 88549672
2-N,7-N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-2-N,7-N-bis[4-[(E)-2-phenylethenyl]phenyl]fluorene-2,7-diamine
CID 58883844
9,9-dimethyl-N,N-dinaphthalen-1-yl-7-[2-[4-(N-phenylanilino)phenyl]ethenyl]fluoren-2-amine
CID 76639589
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(3-methylphenyl)-7-[2-[4-(N-phenylanilino)phenyl]ethenyl]fluoren-2-amine
CID 90693832
N-[4-[2-[4-[10-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]anthracen-9-yl]-2,3,5,6-tetrafluorophenyl]ethenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 123901192
9,9-dimethyl-N-phenyl-N-[4-[2-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]ethenyl]phenyl]fluoren-2-amine
CID 90889703
4-bromo-N,N-diphenylaniline;N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;N-(4-bromophenyl)-N,4-diphenylaniline;N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;N-(4-bromophenyl)-N-phenylnaphthalen-2-amine
CID 159957183
7-[(E)-2-[4-[10-[4-[(E)-2-[9,9-dimethyl-7-(N-phenylanilino)fluoren-2-yl]ethenyl]phenyl]anthracen-9-yl]phenyl]ethenyl]-9,9-dimethyl-N,N-diphenylfluoren-2-amine
CID 59245877
9,9-dimethyl-7-[(E)-2-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]ethenyl]-N,N-diphenylfluoren-2-amine
CID 89068043
N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 59246228
N,N-bis(3,5-dimethylphenyl)-7-[(E)-2-[7-[(E)-2-[7-(N-(3,5-dimethylphenyl)-3,5-dimethylanilino)-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-amine;7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(4-methyl-N-(4-methylphenyl)anilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethyl-N,N-bis(4-methylphenyl)fluoren-2-amine;7-[(E)-2-[10-[(E)-2-[9,9-dimethyl-7-(N-phenylanilino)fluoren-2-yl]ethenyl]anthracen-9-yl]ethenyl]-9,9-dimethyl-N,N-diphenylfluoren-2-amine;7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-phenylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethyl-N,N-diphenylfluoren-2-amine;7-[(E)-2-[7-[(E)-2-[7-(dinaphthalen-2-ylamino)-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethyl-N,N-dinaphthalen-2-ylfluoren-2-amine
CID 158982292

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene?
The IUPAC name of N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene (CID 158405780) is N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene.
What is the SMILES notation for N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene?
The canonical SMILES for N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene is C=Cc1c2ccccc2c(-c2cccc3ccccc23)c2ccccc12.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(/C=C/c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(Br)cc3)cc21.
What is the InChIKey of N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene?
The InChIKey is GYRDIAATYLBFCD-HSQUEQGVSA-N. The full InChI is InChI=1S/C53H39N.C27H22BrN.C26H18/c1-53(2)50-26-13-12-22-45(50)46-34-32-40(35-51(46)53)54(38-17-4-3-5-18-38)39-30-27-36(28-31-39)29-33-44-42-20-8-10-23-48(42)52(49-24-11-9-21-43(44)49)47-25-14-16-37-15-6-7-19-41(37)47;1-27(2)25-11-7-6-10-23(25)24-17-16-22(18-26(24)27)29(20-8-4-3-5-9-20)21-14-12-19(28)13-15-21;1-2-19-21-13-5-7-15-24(21)26(25-16-8-6-14-22(19)25)23-17-9-11-18-10-3-4-12-20(18)23/h3-35H,1-2H3;3-18H,1-2H3;2-17H,1H2/b33-29+;;.
What are the key properties of N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene?
N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene has a molecular weight of 1460.72 g/mol, XLogP of 30.44, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-9,9-dimethyl-N-phenylfluoren-2-amine;9,9-dimethyl-N-[4-[(E)-2-(10-naphthalen-1-ylanthracen-9-yl)ethenyl]phenyl]-N-phenylfluoren-2-amine;9-ethenyl-10-naphthalen-1-ylanthracene is sourced from PubChem (CID 158405780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).