4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine

C188H178N6 — CID 159675939

IUPAC4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine
SMILESCc1ccc(C2(c3ccc(N(c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6c(C)cc(C(C)(C)C)cc6C)cc5)cc4)c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6c(C)cc(C(C)(C)C)cc6C)cc5)cc4)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.Cc1ccc(C2(c3ccc(N(c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc7ccccc7c6)cc5)cc4)c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc7ccccc7c6)cc5)cc4)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1
InChIInChI=1S/C96H99N3.C92H79N3/c1-62-20-32-75(33-21-62)96(88-56-63(2)22-54-86(88)87-55-23-64(3)57-89(87)96)76-38-52-81(53-39-76)97(79-40-24-69(25-41-79)71-28-44-82(45-29-71)98(84-48-34-73(35-49-84)92(8,9)10)90-65(4)58-77(59-66(90)5)94(14,15)16)80-42-26-70(27-43-80)72-30-46-83(47-31-72)99(85-50-36-74(37-51-85)93(11,12)13)91-67(6)60-78(61-68(91)7)95(17,18)19;1-62-18-32-75(33-19-62)92(88-58-63(2)20-56-86(88)87-57-21-64(3)59-89(87)92)76-38-54-81(55-39-76)93(77-40-22-67(23-41-77)69-26-44-79(45-27-69)94(82-50-34-73(35-51-82)90(4,5)6)84-48-30-65-14-10-12-16-71(65)60-84)78-42-24-68(25-43-78)70-28-46-80(47-29-70)95(83-52-36-74(37-53-83)91(7,8)9)85-49-31-66-15-11-13-17-72(66)61-85/h20-61H,1-19H3;10-61H,1-9H3
InChIKeyMUPDECHBVQCKNK-UHFFFAOYSA-N
MW2521.53 g/mol
LogP52.76
Rot. Bonds26

About 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine

4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine (PubChem CID 159675939) has the molecular formula C188H178N6 and a molecular weight of 2521.53 g/mol. Its IUPAC name is 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine.

Molecular Properties

Compound Name4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine
PubChem CID159675939
Molecular FormulaC188H178N6
Molecular Weight2521.53 g/mol
Exact Mass2519.41
IUPAC Name4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine
SMILESCc1ccc(C2(c3ccc(N(c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6c(C)cc(C(C)(C)C)cc6C)cc5)cc4)c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6c(C)cc(C(C)(C)C)cc6C)cc5)cc4)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.Cc1ccc(C2(c3ccc(N(c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc7ccccc7c6)cc5)cc4)c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc7ccccc7c6)cc5)cc4)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1
InChIInChI=1S/C96H99N3.C92H79N3/c1-62-20-32-75(33-21-62)96(88-56-63(2)22-54-86(88)87-55-23-64(3)57-89(87)96)76-38-52-81(53-39-76)97(79-40-24-69(25-41-79)71-28-44-82(45-29-71)98(84-48-34-73(35-49-84)92(8,9)10)90-65(4)58-77(59-66(90)5)94(14,15)16)80-42-26-70(27-43-80)72-30-46-83(47-31-72)99(85-50-36-74(37-51-85)93(11,12)13)91-67(6)60-78(61-68(91)7)95(17,18)19;1-62-18-32-75(33-19-62)92(88-58-63(2)20-56-86(88)87-57-21-64(3)59-89(87)92)76-38-54-81(55-39-76)93(77-40-22-67(23-41-77)69-26-44-79(45-27-69)94(82-50-34-73(35-51-82)90(4,5)6)84-48-30-65-14-10-12-16-71(65)60-84)78-42-24-68(25-43-78)70-28-46-80(47-29-70)95(83-52-36-74(37-53-83)91(7,8)9)85-49-31-66-15-11-13-17-72(66)61-85/h20-61H,1-19H3;10-61H,1-9H3
InChIKeyMUPDECHBVQCKNK-UHFFFAOYSA-N
XLogP52.76
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds26
Heavy Atoms194
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002521.53
LogP ≤ 552.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine?
The IUPAC name of 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine (CID 159675939) is 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine.
What is the SMILES notation for 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine?
The canonical SMILES for 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine is Cc1ccc(C2(c3ccc(N(c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6c(C)cc(C(C)(C)C)cc6C)cc5)cc4)c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6c(C)cc(C(C)(C)C)cc6C)cc5)cc4)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.Cc1ccc(C2(c3ccc(N(c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc7ccccc7c6)cc5)cc4)c4ccc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc7ccccc7c6)cc5)cc4)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.
What is the InChIKey of 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine?
The InChIKey is MUPDECHBVQCKNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H99N3.C92H79N3/c1-62-20-32-75(33-21-62)96(88-56-63(2)22-54-86(88)87-55-23-64(3)57-89(87)96)76-38-52-81(53-39-76)97(79-40-24-69(25-41-79)71-28-44-82(45-29-71)98(84-48-34-73(35-49-84)92(8,9)10)90-65(4)58-77(59-66(90)5)94(14,15)16)80-42-26-70(27-43-80)72-30-46-83(47-31-72)99(85-50-36-74(37-51-85)93(11,12)13)91-67(6)60-78(61-68(91)7)95(17,18)19;1-62-18-32-75(33-19-62)92(88-58-63(2)20-56-86(88)87-57-21-64(3)59-89(87)92)76-38-54-81(55-39-76)93(77-40-22-67(23-41-77)69-26-44-79(45-27-69)94(82-50-34-73(35-51-82)90(4,5)6)84-48-30-65-14-10-12-16-71(65)60-84)78-42-24-68(25-43-78)70-28-46-80(47-29-70)95(83-52-36-74(37-53-83)91(7,8)9)85-49-31-66-15-11-13-17-72(66)61-85/h20-61H,1-19H3;10-61H,1-9H3.
What are the key properties of 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine?
4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine has a molecular weight of 2521.53 g/mol, XLogP of 52.76, 26 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine is sourced from PubChem (CID 159675939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).