9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline

C198H231N5 — CID 161002521

IUPAC9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline
SMILESCCCCCCC1(CCCCCC)c2cc(-c3ccc(C)cc3)ccc2-c2ccc(-c3ccc(N(C)c4ccccc4)cc3)cc21.CCCCCCC1(CCCCCC)c2cc(C)ccc2-c2ccc(N(C)c3ccccc3)cc21.CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(C)c3ccc(-c4c5ccccc5c(-c5ccc(C)cc5)c5ccccc45)cc3)cc21.CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(C)c3ccc(-c4ccc(C)cc4)cc3)cc21.CCCCCCCCc1ccc(N(C)c2ccc(-c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C53H55N.C45H51N.C39H47N.C33H43N.C28H35N/c1-5-7-9-17-35-53(36-18-10-8-6-2)49-24-16-15-19-43(49)44-34-33-42(37-50(44)53)54(4)41-31-29-40(30-32-41)52-47-22-13-11-20-45(47)51(39-27-25-38(3)26-28-39)46-21-12-14-23-48(46)52;1-5-7-9-14-30-45(31-15-10-8-6-2)43-32-37(35-20-18-34(3)19-21-35)24-28-41(43)42-29-25-38(33-44(42)45)36-22-26-40(27-23-36)46(4)39-16-12-11-13-17-39;1-5-7-9-13-27-39(28-14-10-8-6-2)37-16-12-11-15-35(37)36-26-25-34(29-38(36)39)40(4)33-23-21-32(22-24-33)31-19-17-30(3)18-20-31;1-5-7-9-14-22-33(23-15-10-8-6-2)31-24-26(3)18-20-29(31)30-21-19-28(25-32(30)33)34(4)27-16-12-11-13-17-27;1-4-5-6-7-8-9-10-24-13-19-27(20-14-24)29(3)28-21-17-26(18-22-28)25-15-11-23(2)12-16-25/h11-16,19-34,37H,5-10,17-18,35-36H2,1-4H3;11-13,16-29,32-33H,5-10,14-15,30-31H2,1-4H3;11-12,15-26,29H,5-10,13-14,27-28H2,1-4H3;11-13,16-21,24-25H,5-10,14-15,22-23H2,1-4H3;11-22H,4-10H2,1-3H3
InChIKeyTWBLILILTVTINE-UHFFFAOYSA-N
MW2681.06 g/mol
LogP58.86
Rot. Bonds63

About 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline

9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline (PubChem CID 161002521) has the molecular formula C198H231N5 and a molecular weight of 2681.06 g/mol. Its IUPAC name is 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline.

Molecular Properties

Compound Name9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline
PubChem CID161002521
Molecular FormulaC198H231N5
Molecular Weight2681.06 g/mol
Exact Mass2678.82
IUPAC Name9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline
SMILESCCCCCCC1(CCCCCC)c2cc(-c3ccc(C)cc3)ccc2-c2ccc(-c3ccc(N(C)c4ccccc4)cc3)cc21.CCCCCCC1(CCCCCC)c2cc(C)ccc2-c2ccc(N(C)c3ccccc3)cc21.CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(C)c3ccc(-c4c5ccccc5c(-c5ccc(C)cc5)c5ccccc45)cc3)cc21.CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(C)c3ccc(-c4ccc(C)cc4)cc3)cc21.CCCCCCCCc1ccc(N(C)c2ccc(-c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C53H55N.C45H51N.C39H47N.C33H43N.C28H35N/c1-5-7-9-17-35-53(36-18-10-8-6-2)49-24-16-15-19-43(49)44-34-33-42(37-50(44)53)54(4)41-31-29-40(30-32-41)52-47-22-13-11-20-45(47)51(39-27-25-38(3)26-28-39)46-21-12-14-23-48(46)52;1-5-7-9-14-30-45(31-15-10-8-6-2)43-32-37(35-20-18-34(3)19-21-35)24-28-41(43)42-29-25-38(33-44(42)45)36-22-26-40(27-23-36)46(4)39-16-12-11-13-17-39;1-5-7-9-13-27-39(28-14-10-8-6-2)37-16-12-11-15-35(37)36-26-25-34(29-38(36)39)40(4)33-23-21-32(22-24-33)31-19-17-30(3)18-20-31;1-5-7-9-14-22-33(23-15-10-8-6-2)31-24-26(3)18-20-29(31)30-21-19-28(25-32(30)33)34(4)27-16-12-11-13-17-27;1-4-5-6-7-8-9-10-24-13-19-27(20-14-24)29(3)28-21-17-26(18-22-28)25-15-11-23(2)12-16-25/h11-16,19-34,37H,5-10,17-18,35-36H2,1-4H3;11-13,16-29,32-33H,5-10,14-15,30-31H2,1-4H3;11-12,15-26,29H,5-10,13-14,27-28H2,1-4H3;11-13,16-21,24-25H,5-10,14-15,22-23H2,1-4H3;11-22H,4-10H2,1-3H3
InChIKeyTWBLILILTVTINE-UHFFFAOYSA-N
XLogP58.86
TPSA16.20 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds63
Heavy Atoms203
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002681.06
LogP ≤ 558.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline with MolForge

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Related Compounds

9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline
CID 161230667
N-(9,9-dihexylfluoren-2-yl)-9,9-dihexyl-N,7-dimethylfluoren-2-amine
CID 58151400
9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine
CID 58151350
9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;N-[4-[2,5-dimethyl-4-(4-methylphenyl)phenyl]phenyl]-3-hexoxy-N-methylaniline;3-ethyl-N-methyl-N-[4-[6-(4-methylphenyl)-9,10-diphenylanthracen-2-yl]phenyl]aniline;4-hexyl-N-methyl-N-[4-[7-(4-methylphenyl)phenanthren-2-yl]phenyl]aniline
CID 160823883
2-(9,9-dihexylfluoren-2-yl)-7-(9,9-dihexyl-7-methylfluoren-2-yl)-9,9-dihexylfluorene
CID 59512955
N-[4-[10-[4-(N-[3-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]anilino)phenyl]anthracen-9-yl]phenyl]-9,9-dihexyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine
CID 89393937
N-[4-[9,9-dihexyl-7-[4-(N-(4-methylphenyl)anilino)phenyl]fluoren-2-yl]phenyl]-4-methyl-N-phenylaniline
CID 58251082
3-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)-N-[4-(9,9-dihexyl-7-methylfluoren-2-yl)phenyl]-N-methylaniline
CID 58250969
N-[4-(9,9-didodecyl-7-methylfluoren-2-yl)phenyl]-N-[4-[9-[3-[4-(4-hexylphenyl)phenyl]phenyl]carbazol-3-yl]phenyl]-4-methylaniline
CID 170261213
9-(9,9-dioctylfluoren-2-yl)-10-(9-heptyl-9-octylfluoren-2-yl)anthracene
CID 142821206
3-methyl-N-[4-[4-(4-methyl-N-[4-(7-methyl-9,9-dioctylfluoren-2-yl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 23530066
1-N,4-N-bis(4-butylphenyl)-1-N,4-N-bis(4-methylphenyl)benzene-1,4-diamine;2,7-dimethyl-9,9-dioctylfluorene
CID 90971481

Frequently Asked Questions

What is the IUPAC name of 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline?
The IUPAC name of 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline (CID 161002521) is 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline.
What is the SMILES notation for 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline?
The canonical SMILES for 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline is CCCCCCC1(CCCCCC)c2cc(-c3ccc(C)cc3)ccc2-c2ccc(-c3ccc(N(C)c4ccccc4)cc3)cc21.CCCCCCC1(CCCCCC)c2cc(C)ccc2-c2ccc(N(C)c3ccccc3)cc21.CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(C)c3ccc(-c4c5ccccc5c(-c5ccc(C)cc5)c5ccccc45)cc3)cc21.CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(C)c3ccc(-c4ccc(C)cc4)cc3)cc21.CCCCCCCCc1ccc(N(C)c2ccc(-c3ccc(C)cc3)cc2)cc1.
What is the InChIKey of 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline?
The InChIKey is TWBLILILTVTINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H55N.C45H51N.C39H47N.C33H43N.C28H35N/c1-5-7-9-17-35-53(36-18-10-8-6-2)49-24-16-15-19-43(49)44-34-33-42(37-50(44)53)54(4)41-31-29-40(30-32-41)52-47-22-13-11-20-45(47)51(39-27-25-38(3)26-28-39)46-21-12-14-23-48(46)52;1-5-7-9-14-30-45(31-15-10-8-6-2)43-32-37(35-20-18-34(3)19-21-35)24-28-41(43)42-29-25-38(33-44(42)45)36-22-26-40(27-23-36)46(4)39-16-12-11-13-17-39;1-5-7-9-13-27-39(28-14-10-8-6-2)37-16-12-11-15-35(37)36-26-25-34(29-38(36)39)40(4)33-23-21-32(22-24-33)31-19-17-30(3)18-20-31;1-5-7-9-14-22-33(23-15-10-8-6-2)31-24-26(3)18-20-29(31)30-21-19-28(25-32(30)33)34(4)27-16-12-11-13-17-27;1-4-5-6-7-8-9-10-24-13-19-27(20-14-24)29(3)28-21-17-26(18-22-28)25-15-11-23(2)12-16-25/h11-16,19-34,37H,5-10,17-18,35-36H2,1-4H3;11-13,16-29,32-33H,5-10,14-15,30-31H2,1-4H3;11-12,15-26,29H,5-10,13-14,27-28H2,1-4H3;11-13,16-21,24-25H,5-10,14-15,22-23H2,1-4H3;11-22H,4-10H2,1-3H3.
What are the key properties of 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline?
9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline has a molecular weight of 2681.06 g/mol, XLogP of 58.86, 63 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dihexyl-N,7-dimethyl-N-phenylfluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]fluoren-2-amine;9,9-dihexyl-N-methyl-N-[4-(4-methylphenyl)phenyl]fluoren-2-amine;4-[9,9-dihexyl-7-(4-methylphenyl)fluoren-2-yl]-N-methyl-N-phenylaniline;N-methyl-N-[4-(4-methylphenyl)phenyl]-4-octylaniline is sourced from PubChem (CID 161002521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).