2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline

C201H196N8O14Si2 — CID 161110128

IUPAC2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline
SMILESCOc1ccc(N(c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc([Si](C)(C)C(C)(C)C)cc4)cc3)cc2)c2ccc([Si](C)(C)C(C)(C)C)cc2)cc1.COc1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)C(C)(C)c2cc(N(c4ccc(OC)cc4)c4ccc(C(C)(C)C)cc4)ccc2-3)cc1.COc1ccc(N(c2ccc(Oc3ccccc3)cc2)c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(Oc5ccccc5)cc4)cc3)cc2)cc1.COc1ccc(Oc2ccc(N(c3ccc(OC)cc3)c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(Oc6ccc(OC)cc6)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C52H44N2O6.C50H40N2O4.C50H60N2O2Si2.C49H52N2O2/c1-55-45-21-13-41(14-22-45)53(43-17-25-49(26-18-43)59-51-33-29-47(57-3)30-34-51)39-9-5-37(6-10-39)38-7-11-40(12-8-38)54(42-15-23-46(56-2)24-16-42)44-19-27-50(28-20-44)60-52-35-31-48(58-4)32-36-52;1-53-45-29-21-41(22-30-45)51(43-25-33-49(34-26-43)55-47-9-5-3-6-10-47)39-17-13-37(14-18-39)38-15-19-40(20-16-38)52(42-23-31-46(54-2)32-24-42)44-27-35-50(36-28-44)56-48-11-7-4-8-12-48;1-49(2,3)55(9,10)47-33-25-43(26-34-47)51(41-21-29-45(53-7)30-22-41)39-17-13-37(14-18-39)38-15-19-40(20-16-38)52(42-23-31-46(54-8)32-24-42)44-27-35-48(36-28-44)56(11,12)50(4,5)6;1-47(2,3)33-11-15-35(16-12-33)50(37-19-25-41(52-9)26-20-37)39-23-29-43-44-30-24-40(32-46(44)49(7,8)45(43)31-39)51(38-21-27-42(53-10)28-22-38)36-17-13-34(14-18-36)48(4,5)6/h5-36H,1-4H3;3-36H,1-2H3;13-36H,1-12H3;11-32H,1-10H3
InChIKeyUJORCIGQFQUZQY-UHFFFAOYSA-N
MW3003.99 g/mol
LogP55.09
Rot. Bonds47

About 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline

2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline (PubChem CID 161110128) has the molecular formula C201H196N8O14Si2 and a molecular weight of 3003.99 g/mol. Its IUPAC name is 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline.

Molecular Properties

Compound Name2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline
PubChem CID161110128
Molecular FormulaC201H196N8O14Si2
Molecular Weight3003.99 g/mol
Exact Mass3001.44
IUPAC Name2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline
SMILESCOc1ccc(N(c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc([Si](C)(C)C(C)(C)C)cc4)cc3)cc2)c2ccc([Si](C)(C)C(C)(C)C)cc2)cc1.COc1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)C(C)(C)c2cc(N(c4ccc(OC)cc4)c4ccc(C(C)(C)C)cc4)ccc2-3)cc1.COc1ccc(N(c2ccc(Oc3ccccc3)cc2)c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(Oc5ccccc5)cc4)cc3)cc2)cc1.COc1ccc(Oc2ccc(N(c3ccc(OC)cc3)c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(Oc6ccc(OC)cc6)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C52H44N2O6.C50H40N2O4.C50H60N2O2Si2.C49H52N2O2/c1-55-45-21-13-41(14-22-45)53(43-17-25-49(26-18-43)59-51-33-29-47(57-3)30-34-51)39-9-5-37(6-10-39)38-7-11-40(12-8-38)54(42-15-23-46(56-2)24-16-42)44-19-27-50(28-20-44)60-52-35-31-48(58-4)32-36-52;1-53-45-29-21-41(22-30-45)51(43-25-33-49(34-26-43)55-47-9-5-3-6-10-47)39-17-13-37(14-18-39)38-15-19-40(20-16-38)52(42-23-31-46(54-2)32-24-42)44-27-35-50(36-28-44)56-48-11-7-4-8-12-48;1-49(2,3)55(9,10)47-33-25-43(26-34-47)51(41-21-29-45(53-7)30-22-41)39-17-13-37(14-18-39)38-15-19-40(20-16-38)52(42-23-31-46(54-8)32-24-42)44-27-35-48(36-28-44)56(11,12)50(4,5)6;1-47(2,3)33-11-15-35(16-12-33)50(37-19-25-41(52-9)26-20-37)39-23-29-43-44-30-24-40(32-46(44)49(7,8)45(43)31-39)51(38-21-27-42(53-10)28-22-38)36-17-13-34(14-18-36)48(4,5)6/h5-36H,1-4H3;3-36H,1-2H3;13-36H,1-12H3;11-32H,1-10H3
InChIKeyUJORCIGQFQUZQY-UHFFFAOYSA-N
XLogP55.09
TPSA155.14 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds47
Heavy Atoms225
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003003.99
LogP ≤ 555.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline?
The IUPAC name of 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline (CID 161110128) is 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline.
What is the SMILES notation for 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline?
The canonical SMILES for 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline is COc1ccc(N(c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc([Si](C)(C)C(C)(C)C)cc4)cc3)cc2)c2ccc([Si](C)(C)C(C)(C)C)cc2)cc1.COc1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)C(C)(C)c2cc(N(c4ccc(OC)cc4)c4ccc(C(C)(C)C)cc4)ccc2-3)cc1.COc1ccc(N(c2ccc(Oc3ccccc3)cc2)c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(Oc5ccccc5)cc4)cc3)cc2)cc1.COc1ccc(Oc2ccc(N(c3ccc(OC)cc3)c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(Oc6ccc(OC)cc6)cc5)cc4)cc3)cc2)cc1.
What is the InChIKey of 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline?
The InChIKey is UJORCIGQFQUZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H44N2O6.C50H40N2O4.C50H60N2O2Si2.C49H52N2O2/c1-55-45-21-13-41(14-22-45)53(43-17-25-49(26-18-43)59-51-33-29-47(57-3)30-34-51)39-9-5-37(6-10-39)38-7-11-40(12-8-38)54(42-15-23-46(56-2)24-16-42)44-19-27-50(28-20-44)60-52-35-31-48(58-4)32-36-52;1-53-45-29-21-41(22-30-45)51(43-25-33-49(34-26-43)55-47-9-5-3-6-10-47)39-17-13-37(14-18-39)38-15-19-40(20-16-38)52(42-23-31-46(54-2)32-24-42)44-27-35-50(36-28-44)56-48-11-7-4-8-12-48;1-49(2,3)55(9,10)47-33-25-43(26-34-47)51(41-21-29-45(53-7)30-22-41)39-17-13-37(14-18-39)38-15-19-40(20-16-38)52(42-23-31-46(54-8)32-24-42)44-27-35-48(36-28-44)56(11,12)50(4,5)6;1-47(2,3)33-11-15-35(16-12-33)50(37-19-25-41(52-9)26-20-37)39-23-29-43-44-30-24-40(32-46(44)49(7,8)45(43)31-39)51(38-21-27-42(53-10)28-22-38)36-17-13-34(14-18-36)48(4,5)6/h5-36H,1-4H3;3-36H,1-2H3;13-36H,1-12H3;11-32H,1-10H3.
What are the key properties of 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline?
2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline has a molecular weight of 3003.99 g/mol, XLogP of 55.09, 47 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,7-N-bis(4-tert-butylphenyl)-2-N,7-N-bis(4-methoxyphenyl)-9,9-dimethylfluorene-2,7-diamine;N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-[4-(N-[4-[tert-butyl(dimethyl)silyl]phenyl]-4-methoxyanilino)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-[4-(4-methoxyphenoxy)phenyl]anilino)phenyl]-N-[4-(4-methoxyphenoxy)phenyl]-N-(4-methoxyphenyl)aniline;4-[4-(4-methoxy-N-(4-phenoxyphenyl)anilino)phenyl]-N-(4-methoxyphenyl)-N-(4-phenoxyphenyl)aniline is sourced from PubChem (CID 161110128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).