2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine

C230H204N8 — CID 158037526

IUPAC2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine
SMILESCC(C)Cc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CC(C)C)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CC(C)c1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(C(C)C)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CCC(C)c1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(C(C)CC)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CCCCc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CCCC)cc5)ccc4c(-c4ccccc4)c3c2)cc1
InChIInChI=1S/3C58H52N2.C56H48N2/c1-41(2)37-43-25-29-49(30-26-43)59(47-21-13-7-14-22-47)51-33-35-53-55(39-51)57(45-17-9-5-10-18-45)54-36-34-52(40-56(54)58(53)46-19-11-6-12-20-46)60(48-23-15-8-16-24-48)50-31-27-44(28-32-50)38-42(3)4;1-5-41(3)43-27-31-49(32-28-43)59(47-23-15-9-16-24-47)51-35-37-53-55(39-51)57(45-19-11-7-12-20-45)54-38-36-52(40-56(54)58(53)46-21-13-8-14-22-46)60(48-25-17-10-18-26-48)50-33-29-44(30-34-50)42(4)6-2;1-3-5-19-43-29-33-49(34-30-43)59(47-25-15-9-16-26-47)51-37-39-53-55(41-51)57(45-21-11-7-12-22-45)54-40-38-52(42-56(54)58(53)46-23-13-8-14-24-46)60(48-27-17-10-18-28-48)50-35-31-44(32-36-50)20-6-4-2;1-39(2)41-25-29-47(30-26-41)57(45-21-13-7-14-22-45)49-33-35-51-53(37-49)55(43-17-9-5-10-18-43)52-36-34-50(38-54(52)56(51)44-19-11-6-12-20-44)58(46-23-15-8-16-24-46)48-31-27-42(28-32-48)40(3)4/h5-36,39-42H,37-38H2,1-4H3;7-42H,5-6H2,1-4H3;7-18,21-42H,3-6,19-20H2,1-2H3;5-40H,1-4H3
InChIKeyFHYCALIQQLFYTO-UHFFFAOYSA-N
MW3080.22 g/mol
LogP67.42
Rot. Bonds48

About 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine

2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine (PubChem CID 158037526) has the molecular formula C230H204N8 and a molecular weight of 3080.22 g/mol. Its IUPAC name is 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine.

Molecular Properties

Compound Name2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine
PubChem CID158037526
Molecular FormulaC230H204N8
Molecular Weight3080.22 g/mol
Exact Mass3077.62
IUPAC Name2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine
SMILESCC(C)Cc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CC(C)C)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CC(C)c1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(C(C)C)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CCC(C)c1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(C(C)CC)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CCCCc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CCCC)cc5)ccc4c(-c4ccccc4)c3c2)cc1
InChIInChI=1S/3C58H52N2.C56H48N2/c1-41(2)37-43-25-29-49(30-26-43)59(47-21-13-7-14-22-47)51-33-35-53-55(39-51)57(45-17-9-5-10-18-45)54-36-34-52(40-56(54)58(53)46-19-11-6-12-20-46)60(48-23-15-8-16-24-48)50-31-27-44(28-32-50)38-42(3)4;1-5-41(3)43-27-31-49(32-28-43)59(47-23-15-9-16-24-47)51-35-37-53-55(39-51)57(45-19-11-7-12-20-45)54-38-36-52(40-56(54)58(53)46-21-13-8-14-22-46)60(48-25-17-10-18-26-48)50-33-29-44(30-34-50)42(4)6-2;1-3-5-19-43-29-33-49(34-30-43)59(47-25-15-9-16-26-47)51-37-39-53-55(41-51)57(45-21-11-7-12-22-45)54-40-38-52(42-56(54)58(53)46-23-13-8-14-24-46)60(48-27-17-10-18-28-48)50-35-31-44(32-36-50)20-6-4-2;1-39(2)41-25-29-47(30-26-41)57(45-21-13-7-14-22-45)49-33-35-51-53(37-49)55(43-17-9-5-10-18-43)52-36-34-50(38-54(52)56(51)44-19-11-6-12-20-44)58(46-23-15-8-16-24-46)48-31-27-42(28-32-48)40(3)4/h5-36,39-42H,37-38H2,1-4H3;7-42H,5-6H2,1-4H3;7-18,21-42H,3-6,19-20H2,1-2H3;5-40H,1-4H3
InChIKeyFHYCALIQQLFYTO-UHFFFAOYSA-N
XLogP67.42
TPSA25.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds48
Heavy Atoms238
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003080.22
LogP ≤ 567.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine with MolForge

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Related Compounds

6-butan-2-yl-N,9-diphenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine;6-butyl-N,9-diphenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine
CID 161258382
2-N,6-N-dinaphthalen-2-yl-9,10-diphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine
CID 143986181
10-[4-(N-(4-butan-2-ylphenyl)anilino)phenyl]-2,6-ditert-butyl-N-phenyl-N-(4-propan-2-ylphenyl)anthracen-9-amine
CID 89058649
3-N-[4-(N-(4-pentan-2-ylphenyl)anilino)phenyl]-1-N-[4-(N-(4-pentylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine
CID 143286495
2-N-(4-methylphenyl)-2-N,6-N-bis(3-methyl-5-propan-2-ylphenyl)-6-N,9,10-triphenylanthracene-2,6-diamine
CID 143986348
4-(9,10-diphenylanthracen-2-yl)-N-[4-[3-(2-methylpropyl)-6-propylcarbazol-9-yl]phenyl]-N-phenylaniline
CID 163570430
9-(4-butan-2-ylphenyl)-10-(4-phenylphenyl)anthracene
CID 58602181
6-N,6-N,16-N,16-N,3,10,13,20-octakis-phenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(20),2,4(9),5,7,10,12,14(19),15,17-decaene-6,16-diamine
CID 166033321
2-N,2-N,6-N,6-N,9,10-hexakis(4-phenylphenyl)anthracene-2,6-diamine
CID 90194161
1-N,4-N-bis(4-butylphenyl)-4-N-(4-tert-butylphenyl)-1-N-(4-propan-2-ylphenyl)benzene-1,4-diamine
CID 70822243
N-(4-butan-2-ylphenyl)-4-propan-2-yl-N-(4-propan-2-ylphenyl)aniline;ethane
CID 143909835
4-[6-[4-(4-butan-2-ylphenyl)phenyl]-9-(4-propan-2-ylphenyl)carbazol-3-yl]-N,N-diphenylaniline;N-[4-[6-[4-(4-butan-2-ylphenyl)phenyl]-9-(4-propan-2-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 161492117

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine?
The IUPAC name of 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine (CID 158037526) is 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine.
What is the SMILES notation for 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine?
The canonical SMILES for 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine is CC(C)Cc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CC(C)C)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CC(C)c1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(C(C)C)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CCC(C)c1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(C(C)CC)cc5)ccc4c(-c4ccccc4)c3c2)cc1.CCCCc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CCCC)cc5)ccc4c(-c4ccccc4)c3c2)cc1.
What is the InChIKey of 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine?
The InChIKey is FHYCALIQQLFYTO-UHFFFAOYSA-N. The full InChI is InChI=1S/3C58H52N2.C56H48N2/c1-41(2)37-43-25-29-49(30-26-43)59(47-21-13-7-14-22-47)51-33-35-53-55(39-51)57(45-17-9-5-10-18-45)54-36-34-52(40-56(54)58(53)46-19-11-6-12-20-46)60(48-23-15-8-16-24-48)50-31-27-44(28-32-50)38-42(3)4;1-5-41(3)43-27-31-49(32-28-43)59(47-23-15-9-16-24-47)51-35-37-53-55(39-51)57(45-19-11-7-12-20-45)54-38-36-52(40-56(54)58(53)46-21-13-8-14-22-46)60(48-25-17-10-18-26-48)50-33-29-44(30-34-50)42(4)6-2;1-3-5-19-43-29-33-49(34-30-43)59(47-25-15-9-16-26-47)51-37-39-53-55(41-51)57(45-21-11-7-12-22-45)54-40-38-52(42-56(54)58(53)46-23-13-8-14-24-46)60(48-27-17-10-18-28-48)50-35-31-44(32-36-50)20-6-4-2;1-39(2)41-25-29-47(30-26-41)57(45-21-13-7-14-22-45)49-33-35-51-53(37-49)55(43-17-9-5-10-18-43)52-36-34-50(38-54(52)56(51)44-19-11-6-12-20-44)58(46-23-15-8-16-24-46)48-31-27-42(28-32-48)40(3)4/h5-36,39-42H,37-38H2,1-4H3;7-42H,5-6H2,1-4H3;7-18,21-42H,3-6,19-20H2,1-2H3;5-40H,1-4H3.
What are the key properties of 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine?
2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine has a molecular weight of 3080.22 g/mol, XLogP of 67.42, 48 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis(4-butan-2-ylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis(4-butylphenyl)-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N-bis[4-(2-methylpropyl)phenyl]-2-N,6-N,9,10-tetraphenylanthracene-2,6-diamine;2-N,6-N,9,10-tetraphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine is sourced from PubChem (CID 158037526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).