N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine

C228H162N8 — CID 160565250

IUPACN-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)cc4)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4-5)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4-5)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccccc5-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)c4)ccc32)cc1
InChIInChI=1S/C62H42N2.C62H44N2.C55H40N2.C49H36N2/c1-41-24-30-48(31-25-41)64-60-23-13-10-20-54(60)55-38-44(29-37-61(55)64)45-28-35-52-53-36-34-49(63(46-16-6-3-7-17-46)47-32-26-43(27-33-47)42-14-4-2-5-15-42)40-59(53)62(58(52)39-45)56-21-11-8-18-50(56)51-19-9-12-22-57(51)62;1-43-26-32-52(33-27-43)64-60-25-15-14-24-56(60)57-40-46(31-39-61(57)64)47-30-37-54-55-38-36-53(42-59(55)62(58(54)41-47,48-18-8-3-9-19-48)49-20-10-4-11-21-49)63(50-22-12-5-13-23-50)51-34-28-45(29-35-51)44-16-6-2-7-17-44;1-39-23-30-49(31-24-39)57-54-22-11-10-21-52(54)53-38-44(29-36-55(53)57)43-15-12-16-45(37-43)51-20-9-8-19-50(51)42-27-34-48(35-28-42)56(46-17-6-3-7-18-46)47-32-25-41(26-33-47)40-13-4-2-5-14-40;1-35-16-27-45(28-17-35)51-48-15-9-8-14-46(48)47-34-41(26-33-49(47)51)40-20-18-37(19-21-40)39-24-31-44(32-25-39)50(42-12-6-3-7-13-42)43-29-22-38(23-30-43)36-10-4-2-5-11-36/h2-40H,1H3;2-42H,1H3;2-38H,1H3;2-34H,1H3
InChIKeyQZVLEEOKIBCOCZ-UHFFFAOYSA-N
MW3013.86 g/mol
LogP61.29
Rot. Bonds29

About N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine

N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 160565250) has the molecular formula C228H162N8 and a molecular weight of 3013.86 g/mol. Its IUPAC name is N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID160565250
Molecular FormulaC228H162N8
Molecular Weight3013.86 g/mol
Exact Mass3011.29
IUPAC NameN-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)cc4)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4-5)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4-5)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccccc5-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)c4)ccc32)cc1
InChIInChI=1S/C62H42N2.C62H44N2.C55H40N2.C49H36N2/c1-41-24-30-48(31-25-41)64-60-23-13-10-20-54(60)55-38-44(29-37-61(55)64)45-28-35-52-53-36-34-49(63(46-16-6-3-7-17-46)47-32-26-43(27-33-47)42-14-4-2-5-15-42)40-59(53)62(58(52)39-45)56-21-11-8-18-50(56)51-19-9-12-22-57(51)62;1-43-26-32-52(33-27-43)64-60-25-15-14-24-56(60)57-40-46(31-39-61(57)64)47-30-37-54-55-38-36-53(42-59(55)62(58(54)41-47,48-18-8-3-9-19-48)49-20-10-4-11-21-49)63(50-22-12-5-13-23-50)51-34-28-45(29-35-51)44-16-6-2-7-17-44;1-39-23-30-49(31-24-39)57-54-22-11-10-21-52(54)53-38-44(29-36-55(53)57)43-15-12-16-45(37-43)51-20-9-8-19-50(51)42-27-34-48(35-28-42)56(46-17-6-3-7-18-46)47-32-25-41(26-33-47)40-13-4-2-5-14-40;1-35-16-27-45(28-17-35)51-48-15-9-8-14-46(48)47-34-41(26-33-49(47)51)40-20-18-37(19-21-40)39-24-31-44(32-25-39)50(42-12-6-3-7-13-42)43-29-22-38(23-30-43)36-10-4-2-5-11-36/h2-40H,1H3;2-42H,1H3;2-38H,1H3;2-34H,1H3
InChIKeyQZVLEEOKIBCOCZ-UHFFFAOYSA-N
XLogP61.29
TPSA32.68 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds29
Heavy Atoms236
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003013.86
LogP ≤ 561.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine (CID 160565250) is N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine is Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)cc4)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4-5)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4-5)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccccc5-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)c4)ccc32)cc1.
What is the InChIKey of N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is QZVLEEOKIBCOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H42N2.C62H44N2.C55H40N2.C49H36N2/c1-41-24-30-48(31-25-41)64-60-23-13-10-20-54(60)55-38-44(29-37-61(55)64)45-28-35-52-53-36-34-49(63(46-16-6-3-7-17-46)47-32-26-43(27-33-47)42-14-4-2-5-15-42)40-59(53)62(58(52)39-45)56-21-11-8-18-50(56)51-19-9-12-22-57(51)62;1-43-26-32-52(33-27-43)64-60-25-15-14-24-56(60)57-40-46(31-39-61(57)64)47-30-37-54-55-38-36-53(42-59(55)62(58(54)41-47,48-18-8-3-9-19-48)49-20-10-4-11-21-49)63(50-22-12-5-13-23-50)51-34-28-45(29-35-51)44-16-6-2-7-17-44;1-39-23-30-49(31-24-39)57-54-22-11-10-21-52(54)53-38-44(29-36-55(53)57)43-15-12-16-45(37-43)51-20-9-8-19-50(51)42-27-34-48(35-28-42)56(46-17-6-3-7-18-46)47-32-25-41(26-33-47)40-13-4-2-5-14-40;1-35-16-27-45(28-17-35)51-48-15-9-8-14-46(48)47-34-41(26-33-49(47)51)40-20-18-37(19-21-40)39-24-31-44(32-25-39)50(42-12-6-3-7-13-42)43-29-22-38(23-30-43)36-10-4-2-5-11-36/h2-40H,1H3;2-42H,1H3;2-38H,1H3;2-34H,1H3.
What are the key properties of N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine?
N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 3013.86 g/mol, XLogP of 61.29, 29 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-[4-[2-[3-[9-(4-methylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-N,4-diphenylaniline;7'-[9-(4-methylphenyl)carbazol-3-yl]-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;7-[9-(4-methylphenyl)carbazol-3-yl]-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 160565250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).