1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine

C306H252N10O10 — CID 157446420

IUPAC1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine
SMILESCCCCc1cccc2c1oc1c(N(c3ccc(CC)cc3)c3ccc4ccc5c(N(c6ccc(CC)cc6)c6cccc7c6oc6c(CCCC)cccc67)ccc6ccc3c4c65)cccc12.CCCc1cccc2c1oc1c(N(c3ccc(CC)cc3)c3ccc4ccc5c(N(c6ccc(CC)cc6)c6cccc7c6oc6c(CCC)cccc67)ccc6ccc3c4c65)cccc12.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(C(C)C)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C(C)C)cccc23)cc1.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(C)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C)cccc23)cc1.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(CC)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(CC)cccc23)cc1
InChIInChI=1S/C64H56N2O2.2C62H52N2O2.C60H48N2O2.C58H44N2O2/c1-5-9-15-45-17-11-19-49-51-21-13-23-57(63(51)67-61(45)49)65(47-33-25-41(7-3)26-34-47)55-39-31-43-30-38-54-56(40-32-44-29-37-53(55)59(43)60(44)54)66(48-35-27-42(8-4)28-36-48)58-24-14-22-52-50-20-12-18-46(16-10-6-2)62(50)68-64(52)58;1-7-39-21-29-43(30-22-39)63(55-19-11-17-49-47-15-9-13-45(37(3)4)59(47)65-61(49)55)53-35-27-41-26-34-52-54(36-28-42-25-33-51(53)57(41)58(42)52)64(44-31-23-40(8-2)24-32-44)56-20-12-18-50-48-16-10-14-46(38(5)6)60(48)66-62(50)56;1-5-13-43-15-9-17-47-49-19-11-21-55(61(49)65-59(43)47)63(45-31-23-39(7-3)24-32-45)53-37-29-41-28-36-52-54(38-30-42-27-35-51(53)57(41)58(42)52)64(46-33-25-40(8-4)26-34-46)56-22-12-20-50-48-18-10-16-44(14-6-2)60(48)66-62(50)56;1-5-37-21-29-43(30-22-37)61(53-19-11-17-47-45-15-9-13-39(7-3)57(45)63-59(47)53)51-35-27-41-26-34-50-52(36-28-42-25-33-49(51)55(41)56(42)50)62(44-31-23-38(6-2)24-32-44)54-20-12-18-48-46-16-10-14-40(8-4)58(46)64-60(48)54;1-5-37-19-27-41(28-20-37)59(51-17-9-15-45-43-13-7-11-35(3)55(43)61-57(45)51)49-33-25-39-24-32-48-50(34-26-40-23-31-47(49)53(39)54(40)48)60(42-29-21-38(6-2)22-30-42)52-18-10-16-46-44-14-8-12-36(4)56(44)62-58(46)52/h11-14,17-40H,5-10,15-16H2,1-4H3;9-38H,7-8H2,1-6H3;9-12,15-38H,5-8,13-14H2,1-4H3;9-36H,5-8H2,1-4H3;7-34H,5-6H2,1-4H3
InChIKeyBSGVACGCFHPYKF-UHFFFAOYSA-N
MW4229.44 g/mol
LogP90.81
Rot. Bonds54

About 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine

1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine (PubChem CID 157446420) has the molecular formula C306H252N10O10 and a molecular weight of 4229.44 g/mol. Its IUPAC name is 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine.

Molecular Properties

Compound Name1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine
PubChem CID157446420
Molecular FormulaC306H252N10O10
Molecular Weight4229.44 g/mol
Exact Mass4225.95
IUPAC Name1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine
SMILESCCCCc1cccc2c1oc1c(N(c3ccc(CC)cc3)c3ccc4ccc5c(N(c6ccc(CC)cc6)c6cccc7c6oc6c(CCCC)cccc67)ccc6ccc3c4c65)cccc12.CCCc1cccc2c1oc1c(N(c3ccc(CC)cc3)c3ccc4ccc5c(N(c6ccc(CC)cc6)c6cccc7c6oc6c(CCC)cccc67)ccc6ccc3c4c65)cccc12.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(C(C)C)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C(C)C)cccc23)cc1.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(C)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C)cccc23)cc1.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(CC)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(CC)cccc23)cc1
InChIInChI=1S/C64H56N2O2.2C62H52N2O2.C60H48N2O2.C58H44N2O2/c1-5-9-15-45-17-11-19-49-51-21-13-23-57(63(51)67-61(45)49)65(47-33-25-41(7-3)26-34-47)55-39-31-43-30-38-54-56(40-32-44-29-37-53(55)59(43)60(44)54)66(48-35-27-42(8-4)28-36-48)58-24-14-22-52-50-20-12-18-46(16-10-6-2)62(50)68-64(52)58;1-7-39-21-29-43(30-22-39)63(55-19-11-17-49-47-15-9-13-45(37(3)4)59(47)65-61(49)55)53-35-27-41-26-34-52-54(36-28-42-25-33-51(53)57(41)58(42)52)64(44-31-23-40(8-2)24-32-44)56-20-12-18-50-48-16-10-14-46(38(5)6)60(48)66-62(50)56;1-5-13-43-15-9-17-47-49-19-11-21-55(61(49)65-59(43)47)63(45-31-23-39(7-3)24-32-45)53-37-29-41-28-36-52-54(38-30-42-27-35-51(53)57(41)58(42)52)64(46-33-25-40(8-4)26-34-46)56-22-12-20-50-48-18-10-16-44(14-6-2)60(48)66-62(50)56;1-5-37-21-29-43(30-22-37)61(53-19-11-17-47-45-15-9-13-39(7-3)57(45)63-59(47)53)51-35-27-41-26-34-50-52(36-28-42-25-33-49(51)55(41)56(42)50)62(44-31-23-38(6-2)24-32-44)54-20-12-18-48-46-16-10-14-40(8-4)58(46)64-60(48)54;1-5-37-19-27-41(28-20-37)59(51-17-9-15-45-43-13-7-11-35(3)55(43)61-57(45)51)49-33-25-39-24-32-48-50(34-26-40-23-31-47(49)53(39)54(40)48)60(42-29-21-38(6-2)22-30-42)52-18-10-16-46-44-14-8-12-36(4)56(44)62-58(46)52/h11-14,17-40H,5-10,15-16H2,1-4H3;9-38H,7-8H2,1-6H3;9-12,15-38H,5-8,13-14H2,1-4H3;9-36H,5-8H2,1-4H3;7-34H,5-6H2,1-4H3
InChIKeyBSGVACGCFHPYKF-UHFFFAOYSA-N
XLogP90.81
TPSA163.80 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds54
Heavy Atoms326
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004229.44
LogP ≤ 590.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine with MolForge

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Related Compounds

1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-tert-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-methyldibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-phenylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-phenylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine
CID 158782773
1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-trimethylsilylphenyl)-1,2-dihydropyrene-1,6-diamine;1-N,6-N-bis(6-propyldibenzofuran-4-yl)-1-N,6-N-bis(4-trimethylsilylphenyl)-1,2-dihydropyrene-1,6-diamine;4-ethenyl-1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-trimethylsilylphenyl)phenanthrene-1,6-diamine;4-ethenyl-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)-1-N,6-N-bis(4-trimethylsilylphenyl)phenanthrene-1,6-diamine
CID 162059029
1-N-[6-(dimethyl-λ3-iodanyl)dibenzofuran-4-yl]-1-N,6-N-bis(3-methylphenyl)-6-N-(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine
CID 144919297
6-N-(2,5-dimethylphenyl)-1-N-[2-(iodomethyl)-5-methylphenyl]-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine
CID 144919348
1-N,6-N-bis(6-methyldibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)pyrene-1,6-diamine;ethane;toluene
CID 144918792
6-N-dibenzofuran-4-yl-1-N-(6-methyldibenzofuran-4-yl)-1-N,6-N-bis(4-methylphenyl)pyrene-1,6-diamine;ethane
CID 144918751
1-N,6-N-bis(3-ethylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(3-methylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(4-methylphenyl)pyrene-1,6-diamine
CID 161167879
1-N,6-N-bis(3-ethylphenyl)-1-N,6-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(3-methylphenyl)-1-N,6-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(4-methylphenyl)-1-N,6-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(3-propan-2-ylphenyl)pyrene-1,6-diamine
CID 159755671
1-N,6-N-bis(3-tert-butylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(4-tert-butylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(3-propan-2-ylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(4-propan-2-ylphenyl)pyrene-1,6-diamine
CID 158487673
N-(2-ethylphenyl)-N-methyl-6-propan-2-yldibenzofuran-4-amine
CID 138651496
1-N,6-N-bis(4-cyclohexylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(2,4-dimethylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis(3,4-dimethylphenyl)-1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine;1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(3-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis[6-(2-ethylphenyl)dibenzofuran-4-yl]-1-N,6-N-bis(4-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 158323347
5-N,20-N-bis(6-ethyldibenzofuran-4-yl)-5-N,20-N,25,25-tetraphenylhexacyclo[12.11.0.02,7.08,13.015,24.018,23]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18(23),19,21-dodecaene-5,20-diamine;5-N,20-N-bis(6-methyldibenzofuran-4-yl)-5-N,20-N,25,25-tetraphenylhexacyclo[12.11.0.02,7.08,13.015,24.018,23]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18(23),19,21-dodecaene-5,20-diamine;5-N,20-N-di(dibenzothiophen-4-yl)-5-N,20-N,25,25-tetraphenylhexacyclo[12.11.0.02,7.08,13.015,24.018,23]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18(23),19,21-dodecaene-5,20-diamine;5-N,20-N,25,25-tetraphenyl-5-N,20-N-bis(6-propan-2-yldibenzofuran-4-yl)hexacyclo[12.11.0.02,7.08,13.015,24.018,23]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18(23),19,21-dodecaene-5,20-diamine
CID 157158852

Frequently Asked Questions

What is the IUPAC name of 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine?
The IUPAC name of 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine (CID 157446420) is 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine.
What is the SMILES notation for 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine?
The canonical SMILES for 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine is CCCCc1cccc2c1oc1c(N(c3ccc(CC)cc3)c3ccc4ccc5c(N(c6ccc(CC)cc6)c6cccc7c6oc6c(CCCC)cccc67)ccc6ccc3c4c65)cccc12.CCCc1cccc2c1oc1c(N(c3ccc(CC)cc3)c3ccc4ccc5c(N(c6ccc(CC)cc6)c6cccc7c6oc6c(CCC)cccc67)ccc6ccc3c4c65)cccc12.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(C(C)C)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C(C)C)cccc23)cc1.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(C)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C)cccc23)cc1.CCc1ccc(N(c2ccc3ccc4c(N(c5ccc(CC)cc5)c5cccc6c5oc5c(CC)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(CC)cccc23)cc1.
What is the InChIKey of 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine?
The InChIKey is BSGVACGCFHPYKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H56N2O2.2C62H52N2O2.C60H48N2O2.C58H44N2O2/c1-5-9-15-45-17-11-19-49-51-21-13-23-57(63(51)67-61(45)49)65(47-33-25-41(7-3)26-34-47)55-39-31-43-30-38-54-56(40-32-44-29-37-53(55)59(43)60(44)54)66(48-35-27-42(8-4)28-36-48)58-24-14-22-52-50-20-12-18-46(16-10-6-2)62(50)68-64(52)58;1-7-39-21-29-43(30-22-39)63(55-19-11-17-49-47-15-9-13-45(37(3)4)59(47)65-61(49)55)53-35-27-41-26-34-52-54(36-28-42-25-33-51(53)57(41)58(42)52)64(44-31-23-40(8-2)24-32-44)56-20-12-18-50-48-16-10-14-46(38(5)6)60(48)66-62(50)56;1-5-13-43-15-9-17-47-49-19-11-21-55(61(49)65-59(43)47)63(45-31-23-39(7-3)24-32-45)53-37-29-41-28-36-52-54(38-30-42-27-35-51(53)57(41)58(42)52)64(46-33-25-40(8-4)26-34-46)56-22-12-20-50-48-18-10-16-44(14-6-2)60(48)66-62(50)56;1-5-37-21-29-43(30-22-37)61(53-19-11-17-47-45-15-9-13-39(7-3)57(45)63-59(47)53)51-35-27-41-26-34-50-52(36-28-42-25-33-49(51)55(41)56(42)50)62(44-31-23-38(6-2)24-32-44)54-20-12-18-48-46-16-10-14-40(8-4)58(46)64-60(48)54;1-5-37-19-27-41(28-20-37)59(51-17-9-15-45-43-13-7-11-35(3)55(43)61-57(45)51)49-33-25-39-24-32-48-50(34-26-40-23-31-47(49)53(39)54(40)48)60(42-29-21-38(6-2)22-30-42)52-18-10-16-46-44-14-8-12-36(4)56(44)62-58(46)52/h11-14,17-40H,5-10,15-16H2,1-4H3;9-38H,7-8H2,1-6H3;9-12,15-38H,5-8,13-14H2,1-4H3;9-36H,5-8H2,1-4H3;7-34H,5-6H2,1-4H3.
What are the key properties of 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine?
1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine has a molecular weight of 4229.44 g/mol, XLogP of 90.81, 54 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,6-N-bis(6-butyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-ethyldibenzofuran-4-yl)-1-N,6-N-bis(4-ethylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-methyldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propan-2-yldibenzofuran-4-yl)pyrene-1,6-diamine;1-N,6-N-bis(4-ethylphenyl)-1-N,6-N-bis(6-propyldibenzofuran-4-yl)pyrene-1,6-diamine is sourced from PubChem (CID 157446420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).