4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline

C102H94N2 — CID 161215317

IUPAC4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline
SMILESCc1cc(C)cc(-c2ccc(C)cc2-c2ccc(N(c3ccc(-c4ccc(C)cc4-c4cc(C)cc(C)c4)cc3)c3ccc(C4(c5ccc(N(c6ccc(-c7ccc(C)cc7-c7cc(C)cc(C)c7)cc6)c6ccc(-c7cc(C)ccc7-c7cc(C)cc(C)c7)cc6)cc5)CCCCC4)cc3)cc2)c1
InChIInChI=1S/C102H94N2/c1-66-18-46-96(82-54-70(5)50-71(6)55-82)98(62-66)80-24-36-90(37-25-80)103(88-32-20-78(21-33-88)94-44-16-68(3)64-100(94)84-58-74(9)52-75(10)59-84)92-40-28-86(29-41-92)102(48-14-13-15-49-102)87-30-42-93(43-31-87)104(89-34-22-79(23-35-89)95-45-17-69(4)65-101(95)85-60-76(11)53-77(12)61-85)91-38-26-81(27-39-91)99-63-67(2)19-47-97(99)83-56-72(7)51-73(8)57-83/h16-47,50-65H,13-15,48-49H2,1-12H3
InChIKeyAEFUHYUZQHQGLA-UHFFFAOYSA-N
MW1347.89 g/mol
LogP28.91
Rot. Bonds16

About 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline

4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline (PubChem CID 161215317) has the molecular formula C102H94N2 and a molecular weight of 1347.89 g/mol. Its IUPAC name is 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline.

Molecular Properties

Compound Name4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline
PubChem CID161215317
Molecular FormulaC102H94N2
Molecular Weight1347.89 g/mol
Exact Mass1346.74
IUPAC Name4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline
SMILESCc1cc(C)cc(-c2ccc(C)cc2-c2ccc(N(c3ccc(-c4ccc(C)cc4-c4cc(C)cc(C)c4)cc3)c3ccc(C4(c5ccc(N(c6ccc(-c7ccc(C)cc7-c7cc(C)cc(C)c7)cc6)c6ccc(-c7cc(C)ccc7-c7cc(C)cc(C)c7)cc6)cc5)CCCCC4)cc3)cc2)c1
InChIInChI=1S/C102H94N2/c1-66-18-46-96(82-54-70(5)50-71(6)55-82)98(62-66)80-24-36-90(37-25-80)103(88-32-20-78(21-33-88)94-44-16-68(3)64-100(94)84-58-74(9)52-75(10)59-84)92-40-28-86(29-41-92)102(48-14-13-15-49-102)87-30-42-93(43-31-87)104(89-34-22-79(23-35-89)95-45-17-69(4)65-101(95)85-60-76(11)53-77(12)61-85)91-38-26-81(27-39-91)99-63-67(2)19-47-97(99)83-56-72(7)51-73(8)57-83/h16-47,50-65H,13-15,48-49H2,1-12H3
InChIKeyAEFUHYUZQHQGLA-UHFFFAOYSA-N
XLogP28.91
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms104
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001347.89
LogP ≤ 528.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline with MolForge

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Related Compounds

4-methyl-N-[4-[1-[4-(4-methyl-N-[4-(4-methylphenyl)phenyl]anilino)phenyl]cyclohexyl]phenyl]-N-[4-(4-methylphenyl)phenyl]aniline
CID 58312147
4-methyl-N,N-bis(4-methylphenyl)aniline;4-methyl-N-[4-[1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]cyclohexyl]phenyl]-N-(4-methylphenyl)aniline
CID 87837292
ethane;4-methyl-N-[4-[1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]cyclohexyl]phenyl]-N-(4-methylphenyl)aniline
CID 156728878
2,4,6-trimethyl-N-(2,4,6-trimethylphenyl)-N-[4-[1-[4-(2,4,6-trimethyl-N-(2,4,6-trimethylphenyl)anilino)phenyl]cyclohexyl]phenyl]aniline
CID 166506077
4-[1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]cyclohexyl]-N,2-bis(4-methylphenyl)aniline
CID 58876490
4-methyl-N-[4-[1-[4-(4-methyl-N-[4-[2-(4-methylphenyl)ethenyl]phenyl]anilino)phenyl]cyclohexyl]phenyl]-N-[4-[2-(4-methylphenyl)ethenyl]phenyl]aniline
CID 68590819
4-methyl-N-[4-[1-[4-(4-methyl-N-[4-(2-propylphenyl)phenyl]anilino)phenyl]cyclohexyl]phenyl]-N-[4-(2-propylphenyl)phenyl]aniline
CID 59630253
3-N-[4-[1-[4-(N-[3-(diethylamino)phenyl]-4-methylanilino)phenyl]cyclohexyl]phenyl]-1-N,1-N-diethyl-3-N-(4-methylphenyl)benzene-1,3-diamine
CID 20761197
4-methyl-N-(4-methylcyclohexyl)-N-[4-[1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]cyclohexyl]phenyl]aniline
CID 129067747
N-[4-(4-methylphenyl)phenyl]-3-[1-[3-(N-[4-(4-methylphenyl)phenyl]anilino)phenyl]cyclohexyl]-N-phenylaniline
CID 146427796
[4-[1-[4-(4-methyl-N-[4-(4-methylphenyl)phenyl]anilino)phenyl]cyclohexyl]phenyl] propanoate
CID 58814424
N-(3,4-dimethylphenyl)-N-[4-[1-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]cyclopentyl]phenyl]-3,4-dimethylaniline
CID 59575404

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline?
The IUPAC name of 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline (CID 161215317) is 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline.
What is the SMILES notation for 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline?
The canonical SMILES for 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline is Cc1cc(C)cc(-c2ccc(C)cc2-c2ccc(N(c3ccc(-c4ccc(C)cc4-c4cc(C)cc(C)c4)cc3)c3ccc(C4(c5ccc(N(c6ccc(-c7ccc(C)cc7-c7cc(C)cc(C)c7)cc6)c6ccc(-c7cc(C)ccc7-c7cc(C)cc(C)c7)cc6)cc5)CCCCC4)cc3)cc2)c1.
What is the InChIKey of 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline?
The InChIKey is AEFUHYUZQHQGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H94N2/c1-66-18-46-96(82-54-70(5)50-71(6)55-82)98(62-66)80-24-36-90(37-25-80)103(88-32-20-78(21-33-88)94-44-16-68(3)64-100(94)84-58-74(9)52-75(10)59-84)92-40-28-86(29-41-92)102(48-14-13-15-49-102)87-30-42-93(43-31-87)104(89-34-22-79(23-35-89)95-45-17-69(4)65-101(95)85-60-76(11)53-77(12)61-85)91-38-26-81(27-39-91)99-63-67(2)19-47-97(99)83-56-72(7)51-73(8)57-83/h16-47,50-65H,13-15,48-49H2,1-12H3.
What are the key properties of 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline?
4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline has a molecular weight of 1347.89 g/mol, XLogP of 28.91, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[1-[4-[4-[2-(3,5-dimethylphenyl)-4-methylphenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]anilino]phenyl]cyclohexyl]phenyl]-N-[4-[2-(3,5-dimethylphenyl)-5-methylphenyl]phenyl]aniline is sourced from PubChem (CID 161215317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).