9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine

C206H160N4 — CID 160911729

IUPAC9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine
SMILESCC(C)c1cc(-c2ccccc2)ccc1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.CC1(C)c2ccccc2-c2c(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3ccc(-c4ccccc4)cc3-c3ccccc3)cccc21.Cc1cc(-c2ccccc2)cc(-c2ccccc2)c1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.Cc1cc(-c2ccccc2)cc(C)c1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C
InChIInChI=1S/C54H41N.C53H39N.C50H41N.C49H39N/c1-36-33-41(37-17-6-4-7-18-37)35-48(38-19-8-5-9-20-38)53(36)55(51-28-16-27-50-52(51)46-25-14-15-26-49(46)54(50,2)3)42-31-29-39(30-32-42)47-34-40-21-10-11-22-43(40)44-23-12-13-24-45(44)47;1-53(2)48-25-14-13-24-45(48)52-49(53)26-15-27-51(52)54(50-33-30-39(36-16-5-3-6-17-36)34-47(50)37-18-7-4-8-19-37)41-31-28-38(29-32-41)46-35-40-20-9-10-21-42(40)43-22-11-12-23-44(43)46;1-33(2)43-31-36(34-15-6-5-7-16-34)27-30-47(43)51(48-24-14-23-46-49(48)42-21-12-13-22-45(42)50(46,3)4)38-28-25-35(26-29-38)44-32-37-17-8-9-18-39(37)40-19-10-11-20-41(40)44;1-32-29-37(34-15-6-5-7-16-34)30-33(2)48(32)50(46-24-14-23-45-47(46)42-21-12-13-22-44(42)49(45,3)4)38-27-25-35(26-28-38)43-31-36-17-8-9-18-39(36)40-19-10-11-20-41(40)43/h4-35H,1-3H3;3-35H,1-2H3;5-33H,1-4H3;5-31H,1-4H3
InChIKeySQWKEOBSFNJEQX-UHFFFAOYSA-N
MW2691.57 g/mol
LogP57.80
Rot. Bonds23

About 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine

9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine (PubChem CID 160911729) has the molecular formula C206H160N4 and a molecular weight of 2691.57 g/mol. Its IUPAC name is 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine
PubChem CID160911729
Molecular FormulaC206H160N4
Molecular Weight2691.57 g/mol
Exact Mass2689.26
IUPAC Name9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine
SMILESCC(C)c1cc(-c2ccccc2)ccc1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.CC1(C)c2ccccc2-c2c(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3ccc(-c4ccccc4)cc3-c3ccccc3)cccc21.Cc1cc(-c2ccccc2)cc(-c2ccccc2)c1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.Cc1cc(-c2ccccc2)cc(C)c1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C
InChIInChI=1S/C54H41N.C53H39N.C50H41N.C49H39N/c1-36-33-41(37-17-6-4-7-18-37)35-48(38-19-8-5-9-20-38)53(36)55(51-28-16-27-50-52(51)46-25-14-15-26-49(46)54(50,2)3)42-31-29-39(30-32-42)47-34-40-21-10-11-22-43(40)44-23-12-13-24-45(44)47;1-53(2)48-25-14-13-24-45(48)52-49(53)26-15-27-51(52)54(50-33-30-39(36-16-5-3-6-17-36)34-47(50)37-18-7-4-8-19-37)41-31-28-38(29-32-41)46-35-40-20-9-10-21-42(40)43-22-11-12-23-44(43)46;1-33(2)43-31-36(34-15-6-5-7-16-34)27-30-47(43)51(48-24-14-23-46-49(48)42-21-12-13-22-45(42)50(46,3)4)38-28-25-35(26-29-38)44-32-37-17-8-9-18-39(37)40-19-10-11-20-41(40)44;1-32-29-37(34-15-6-5-7-16-34)30-33(2)48(32)50(46-24-14-23-45-47(46)42-21-12-13-22-44(42)49(45,3)4)38-27-25-35(26-28-38)43-31-36-17-8-9-18-39(36)40-19-10-11-20-41(40)43/h4-35H,1-3H3;3-35H,1-2H3;5-33H,1-4H3;5-31H,1-4H3
InChIKeySQWKEOBSFNJEQX-UHFFFAOYSA-N
XLogP57.80
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds23
Heavy Atoms210
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002691.57
LogP ≤ 557.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine?
The IUPAC name of 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine (CID 160911729) is 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine.
What is the SMILES notation for 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine?
The canonical SMILES for 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine is CC(C)c1cc(-c2ccccc2)ccc1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.CC1(C)c2ccccc2-c2c(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3ccc(-c4ccccc4)cc3-c3ccccc3)cccc21.Cc1cc(-c2ccccc2)cc(-c2ccccc2)c1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.Cc1cc(-c2ccccc2)cc(C)c1N(c1ccc(-c2cc3ccccc3c3ccccc23)cc1)c1cccc2c1-c1ccccc1C2(C)C.
What is the InChIKey of 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine?
The InChIKey is SQWKEOBSFNJEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H41N.C53H39N.C50H41N.C49H39N/c1-36-33-41(37-17-6-4-7-18-37)35-48(38-19-8-5-9-20-38)53(36)55(51-28-16-27-50-52(51)46-25-14-15-26-49(46)54(50,2)3)42-31-29-39(30-32-42)47-34-40-21-10-11-22-43(40)44-23-12-13-24-45(44)47;1-53(2)48-25-14-13-24-45(48)52-49(53)26-15-27-51(52)54(50-33-30-39(36-16-5-3-6-17-36)34-47(50)37-18-7-4-8-19-37)41-31-28-38(29-32-41)46-35-40-20-9-10-21-42(40)43-22-11-12-23-44(43)46;1-33(2)43-31-36(34-15-6-5-7-16-34)27-30-47(43)51(48-24-14-23-46-49(48)42-21-12-13-22-45(42)50(46,3)4)38-28-25-35(26-29-38)44-32-37-17-8-9-18-39(37)40-19-10-11-20-41(40)44;1-32-29-37(34-15-6-5-7-16-34)30-33(2)48(32)50(46-24-14-23-45-47(46)42-21-12-13-22-44(42)49(45,3)4)38-27-25-35(26-28-38)43-31-36-17-8-9-18-39(36)40-19-10-11-20-41(40)43/h4-35H,1-3H3;3-35H,1-2H3;5-33H,1-4H3;5-31H,1-4H3.
What are the key properties of 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine?
9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine has a molecular weight of 2691.57 g/mol, XLogP of 57.80, 23 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-(2-methyl-4,6-diphenylphenyl)-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)-N-(4-phenyl-2-propan-2-ylphenyl)fluoren-4-amine;N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenanthren-9-ylphenyl)fluoren-4-amine is sourced from PubChem (CID 160911729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).