1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine

C398H274F10N30 — CID 157071911

IUPAC1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine
SMILESCC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ccncn6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cnc7ccccc7n6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cnccn6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cncnc6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6nc7ccccc7cc6F)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7c6F)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7n6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncnc7ccccc67)ccc6ccc3c4c65)cccc21
InChIInChI=1S/2C52H35F2N3.3C51H35FN4.3C47H33FN4/c1-52(2)39-17-8-7-16-36(39)50-40(52)18-12-22-47(50)57(46-21-11-9-19-41(46)53)45-30-26-33-23-27-37-44(29-25-32-24-28-38(45)49(33)48(32)37)56(35-14-4-3-5-15-35)51-42(54)31-34-13-6-10-20-43(34)55-51;1-52(2)40-18-9-8-17-37(40)49-41(52)19-12-22-46(49)57(45-21-11-10-20-42(45)53)44-30-26-33-23-27-38-43(29-25-32-24-28-39(44)48(33)47(32)38)56(35-14-4-3-5-15-35)51-50(54)36-16-7-6-13-34(36)31-55-51;1-51(2)39-17-8-7-16-36(39)49-40(51)18-12-22-46(49)56(45-21-11-9-19-41(45)52)44-30-26-33-23-27-37-43(29-25-32-24-28-38(44)48(33)47(32)37)55(35-14-4-3-5-15-35)50-53-31-34-13-6-10-20-42(34)54-50;1-51(2)39-17-8-6-15-35(39)49-40(51)18-12-22-46(49)56(45-21-11-9-19-41(45)52)44-30-26-33-23-27-37-43(29-25-32-24-28-38(44)48(33)47(32)37)55(34-13-4-3-5-14-34)50-36-16-7-10-20-42(36)53-31-54-50;1-51(2)38-16-7-6-15-35(38)50-39(51)17-12-22-46(50)56(45-21-11-8-18-40(45)52)44-30-26-33-23-27-36-43(29-25-32-24-28-37(44)49(33)48(32)36)55(34-13-4-3-5-14-34)47-31-53-41-19-9-10-20-42(41)54-47;1-47(2)37-14-7-6-13-34(37)46-38(47)15-10-18-43(46)52(42-17-9-8-16-39(42)48)41-26-22-31-19-23-35-40(25-21-30-20-24-36(41)45(31)44(30)35)51(32-11-4-3-5-12-32)33-27-49-29-50-28-33;1-47(2)36-14-7-6-13-33(36)46-37(47)15-10-18-42(46)52(41-17-9-8-16-38(41)48)40-26-22-31-19-23-34-39(25-21-30-20-24-35(40)45(31)44(30)34)51(32-11-4-3-5-12-32)43-29-49-27-28-50-43;1-47(2)36-14-7-6-13-33(36)46-37(47)15-10-18-42(46)52(41-17-9-8-16-38(41)48)40-26-22-31-19-23-34-39(25-21-30-20-24-35(40)45(31)44(30)34)51(32-11-4-3-5-12-32)43-27-28-49-29-50-43/h2*3-31H,1-2H3;3*3-31H,1-2H3;3*3-29H,1-2H3
InChIKeyACNKWUKYZSHTLO-UHFFFAOYSA-N
MW5666.76 g/mol
LogP109.33
Rot. Bonds48

About 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine

1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine (PubChem CID 157071911) has the molecular formula C398H274F10N30 and a molecular weight of 5666.76 g/mol. Its IUPAC name is 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine.

Molecular Properties

Compound Name1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine
PubChem CID157071911
Molecular FormulaC398H274F10N30
Molecular Weight5666.76 g/mol
Exact Mass5662.22
IUPAC Name1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine
SMILESCC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ccncn6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cnc7ccccc7n6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cnccn6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cncnc6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6nc7ccccc7cc6F)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7c6F)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7n6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncnc7ccccc67)ccc6ccc3c4c65)cccc21
InChIInChI=1S/2C52H35F2N3.3C51H35FN4.3C47H33FN4/c1-52(2)39-17-8-7-16-36(39)50-40(52)18-12-22-47(50)57(46-21-11-9-19-41(46)53)45-30-26-33-23-27-37-44(29-25-32-24-28-38(45)49(33)48(32)37)56(35-14-4-3-5-15-35)51-42(54)31-34-13-6-10-20-43(34)55-51;1-52(2)40-18-9-8-17-37(40)49-41(52)19-12-22-46(49)57(45-21-11-10-20-42(45)53)44-30-26-33-23-27-38-43(29-25-32-24-28-39(44)48(33)47(32)38)56(35-14-4-3-5-15-35)51-50(54)36-16-7-6-13-34(36)31-55-51;1-51(2)39-17-8-7-16-36(39)49-40(51)18-12-22-46(49)56(45-21-11-9-19-41(45)52)44-30-26-33-23-27-37-43(29-25-32-24-28-38(44)48(33)47(32)37)55(35-14-4-3-5-15-35)50-53-31-34-13-6-10-20-42(34)54-50;1-51(2)39-17-8-6-15-35(39)49-40(51)18-12-22-46(49)56(45-21-11-9-19-41(45)52)44-30-26-33-23-27-37-43(29-25-32-24-28-38(44)48(33)47(32)37)55(34-13-4-3-5-14-34)50-36-16-7-10-20-42(36)53-31-54-50;1-51(2)38-16-7-6-15-35(38)50-39(51)17-12-22-46(50)56(45-21-11-8-18-40(45)52)44-30-26-33-23-27-36-43(29-25-32-24-28-37(44)49(33)48(32)36)55(34-13-4-3-5-14-34)47-31-53-41-19-9-10-20-42(41)54-47;1-47(2)37-14-7-6-13-34(37)46-38(47)15-10-18-43(46)52(42-17-9-8-16-39(42)48)41-26-22-31-19-23-35-40(25-21-30-20-24-36(41)45(31)44(30)35)51(32-11-4-3-5-12-32)33-27-49-29-50-28-33;1-47(2)36-14-7-6-13-33(36)46-37(47)15-10-18-42(46)52(41-17-9-8-16-38(41)48)40-26-22-31-19-23-34-39(25-21-30-20-24-35(40)45(31)44(30)34)51(32-11-4-3-5-12-32)43-29-49-27-28-50-43;1-47(2)36-14-7-6-13-33(36)46-37(47)15-10-18-42(46)52(41-17-9-8-16-38(41)48)40-26-22-31-19-23-34-39(25-21-30-20-24-35(40)45(31)44(30)34)51(32-11-4-3-5-12-32)43-27-28-49-29-50-43/h2*3-31H,1-2H3;3*3-31H,1-2H3;3*3-29H,1-2H3
InChIKeyACNKWUKYZSHTLO-UHFFFAOYSA-N
XLogP109.33
TPSA232.30 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds48
Heavy Atoms438
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005666.76
LogP ≤ 5109.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine with MolForge

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Related Compounds

1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine
CID 89799010
1-N-(9,9-dimethylfluoren-4-yl)-1-N-(3-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine
CID 89799027
1-N-(9,9-dimethylfluoren-4-yl)-1-N-(3-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine
CID 89799028
6-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluorophenyl)-1-N-phenyl-1-N-quinazolin-2-ylpyrene-1,6-diamine
CID 89799041
6-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluorophenyl)-1-N-phenyl-1-N-quinoxalin-2-ylpyrene-1,6-diamine
CID 89799044
1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-yl-1-N-(9,9'-spirobi[fluorene]-4-yl)pyrene-1,6-diamine
CID 89799072
1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-yl-1-N-(9,9'-spirobi[fluorene]-4-yl)pyrene-1,6-diamine
CID 89799073
1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-yl-1-N-(9,9'-spirobi[fluorene]-4-yl)pyrene-1,6-diamine
CID 89799075
N-[4-[7-[4-[2-fluoro-N-(9,9'-spirobi[fluorene]-4-yl)anilino]phenyl]benzo[k]fluoranthen-12-yl]phenyl]-N-phenylpyrimidin-4-amine
CID 89799104
N-[4-[7-[4-[2-fluoro-N-(9,9'-spirobi[fluorene]-4-yl)anilino]phenyl]benzo[k]fluoranthen-12-yl]phenyl]-N-phenylpyrimidin-5-amine
CID 89799107
N-[4-[7-[4-[2-fluoro-N-(9,9'-spirobi[fluorene]-4-yl)anilino]phenyl]benzo[k]fluoranthen-12-yl]phenyl]-N-phenylquinazolin-2-amine
CID 89799110
N-[4-[7-[4-[2-fluoro-N-(9,9'-spirobi[fluorene]-4-yl)anilino]phenyl]benzo[k]fluoranthen-12-yl]phenyl]-N-phenylquinazolin-4-amine
CID 89799112

Frequently Asked Questions

What is the IUPAC name of 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine?
The IUPAC name of 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine (CID 157071911) is 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine.
What is the SMILES notation for 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine?
The canonical SMILES for 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine is CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ccncn6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cnc7ccccc7n6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cnccn6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6cncnc6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6nc7ccccc7cc6F)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7c6F)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7n6)ccc6ccc3c4c65)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccccc3F)c3ccc4ccc5c(N(c6ccccc6)c6ncnc7ccccc67)ccc6ccc3c4c65)cccc21.
What is the InChIKey of 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine?
The InChIKey is ACNKWUKYZSHTLO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H35F2N3.3C51H35FN4.3C47H33FN4/c1-52(2)39-17-8-7-16-36(39)50-40(52)18-12-22-47(50)57(46-21-11-9-19-41(46)53)45-30-26-33-23-27-37-44(29-25-32-24-28-38(45)49(33)48(32)37)56(35-14-4-3-5-15-35)51-42(54)31-34-13-6-10-20-43(34)55-51;1-52(2)40-18-9-8-17-37(40)49-41(52)19-12-22-46(49)57(45-21-11-10-20-42(45)53)44-30-26-33-23-27-38-43(29-25-32-24-28-39(44)48(33)47(32)38)56(35-14-4-3-5-15-35)51-50(54)36-16-7-6-13-34(36)31-55-51;1-51(2)39-17-8-7-16-36(39)49-40(51)18-12-22-46(49)56(45-21-11-9-19-41(45)52)44-30-26-33-23-27-37-43(29-25-32-24-28-38(44)48(33)47(32)37)55(35-14-4-3-5-15-35)50-53-31-34-13-6-10-20-42(34)54-50;1-51(2)39-17-8-6-15-35(39)49-40(51)18-12-22-46(49)56(45-21-11-9-19-41(45)52)44-30-26-33-23-27-37-43(29-25-32-24-28-38(44)48(33)47(32)37)55(34-13-4-3-5-14-34)50-36-16-7-10-20-42(36)53-31-54-50;1-51(2)38-16-7-6-15-35(38)50-39(51)17-12-22-46(50)56(45-21-11-8-18-40(45)52)44-30-26-33-23-27-36-43(29-25-32-24-28-37(44)49(33)48(32)36)55(34-13-4-3-5-14-34)47-31-53-41-19-9-10-20-42(41)54-47;1-47(2)37-14-7-6-13-34(37)46-38(47)15-10-18-43(46)52(42-17-9-8-16-39(42)48)41-26-22-31-19-23-35-40(25-21-30-20-24-36(41)45(31)44(30)35)51(32-11-4-3-5-12-32)33-27-49-29-50-28-33;1-47(2)36-14-7-6-13-33(36)46-37(47)15-10-18-42(46)52(41-17-9-8-16-38(41)48)40-26-22-31-19-23-34-39(25-21-30-20-24-35(40)45(31)44(30)34)51(32-11-4-3-5-12-32)43-29-49-27-28-50-43;1-47(2)36-14-7-6-13-33(36)46-37(47)15-10-18-42(46)52(41-17-9-8-16-38(41)48)40-26-22-31-19-23-34-39(25-21-30-20-24-35(40)45(31)44(30)34)51(32-11-4-3-5-12-32)43-27-28-49-29-50-43/h2*3-31H,1-2H3;3*3-31H,1-2H3;3*3-29H,1-2H3.
What are the key properties of 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine?
1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine has a molecular weight of 5666.76 g/mol, XLogP of 109.33, 48 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(9,9-dimethylfluoren-4-yl)-6-N-(4-fluoroisoquinolin-3-yl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-(3-fluoroquinolin-2-yl)-6-N-phenylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrazin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-pyrimidin-5-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-2-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinazolin-4-ylpyrene-1,6-diamine;1-N-(9,9-dimethylfluoren-4-yl)-1-N-(2-fluorophenyl)-6-N-phenyl-6-N-quinoxalin-2-ylpyrene-1,6-diamine is sourced from PubChem (CID 157071911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).